- InChI
- InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3
- InChI Key
- CATSNJVOTSVZJV-UHFFFAOYSA-N
- Formula
- C7H14O
- SMILES
- CCCCCC(C)=O
- Molecular Weight1
- 114.19
- CAS
- 110-43-0
- Other Names
-
- 2-Heptanal
- 2-Ketoheptane
- Amyl methyl ketone
- Amyl-methyl-cetone
- BUTYLACETONE
- Heptan-2-one
- Heptanone-2
- Ketone C-7
- Ketone, methyl pentyl
- Methyl amyl ketone
- Methyl n-amyl ketone
- Methyl n-pentyl ketone
- Methyl pentyl ketone
- Methyl-amyl-cetone
- N-PENTYL METHYL KETONE
- NSC 7313
- Pentyl methyl ketone
- UN 1110
- n-Amyl methyl ketone
- n-C5H11COCH3
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- LFL : Lower Flammability Limit (% in Air).
- UFL : Upper Flammability Limit (% in Air).
- Tflash,cc : Flash Point (Closed Cup Method) (K).
- Tflash,oc : Flash Point (Open Cup Method) (K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- NFPA Fire : NFPA Fire Rating.
- NFPA Health : NFPA Health Rating.
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- ρc : Critical density (kg/m3).
- ρl : Liquid Density (kg/m3).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- csound,fluid : Speed of sound in fluid (m/s).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.4830 | KDB | |
| LFL | 1.11 | % in Air | KDB |
| UFL | 7.90 | % in Air | KDB |
| Tflash,cc | 320.37 | K | KDB |
| Tflash,oc | 312.04 | K | KDB |
| ΔfG° | -120.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -300.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.09 | kJ/mol | Measure... |
| ΔvapH° | [46.10; 48.50] | kJ/mol |
|
| ΔvapH° | 46.10 | kJ/mol | NIST |
| ΔvapH° | 48.50 | kJ/mol | NIST |
| ΔvapH° | 47.40 ± 0.30 | kJ/mol | NIST |
| ΔvapH° | 47.24 ± 0.05 | kJ/mol | NIST |
| ΔvapH° | 47.20 ± 0.10 | kJ/mol | NIST |
| ΔvapH° | 48.00 | kJ/mol | NIST |
| IE | [9.18; 9.79] | eV |
|
| IE | 9.27 ± 0.06 | eV | NIST |
| IE | 9.18 ± 0.02 | eV | NIST |
| IE | 9.30 ± 0.01 | eV | NIST |
| IE | Outlier 9.79 | eV | NIST |
| IE | 9.33 ± 0.03 | eV | NIST |
| IE | 9.36 | eV | NIST |
| log10WS | [-1.45; -1.42] |
|
|
| log10WS | -1.42 | Aq. Sol... | |
| log10WS | -1.45 | Estimat... | |
| logPoct/wat | 2.156 | Crippen Calculated Property | |
| McVol | 111.060 | ml/mol | McGowan Calculated Property |
| NFPA Fire | 2 | KDB | |
| NFPA Health | 1 | KDB | |
| Pc | [3436.00; 3440.00] | kPa |
|
| Pc | 3436.00 | kPa | KDB |
| Pc | 3440.00 ± 4.00 | kPa | NIST |
| ρc | 261.48 ± 3.43 | kg/m3 | NIST |
| Inp | [838.00; 911.00] |
|
|
| Inp | 868.70 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 870.20 | NIST | |
| Inp | 876.50 | NIST | |
| Inp | 892.30 | NIST | |
| Inp | 893.30 | NIST | |
| Inp | 894.70 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 855.00 | NIST | |
| Inp | Outlier 846.00 | NIST | |
| Inp | Outlier 838.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | Outlier 845.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | Outlier 846.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | Outlier 849.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 877.10 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | Outlier 846.90 | NIST | |
| Inp | 887.30 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 869.90 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 887.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 863.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 860.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 866.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | Outlier 844.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | Outlier 852.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | Outlier 844.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 885.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 866.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 866.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 893.70 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 871.95 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 886.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 863.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 860.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | Outlier 911.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 887.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 886.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 863.00 | NIST | |
| Inp | 908.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 886.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 886.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 886.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | Outlier 846.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 877.10 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 866.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 868.70 | NIST | |
| Inp | 870.20 | NIST | |
| Inp | Outlier 838.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 884.00 | NIST | |
| I | [1145.00; 1216.00] |
|
|
| I | Outlier 1213.80 | NIST | |
| I | 1195.80 | NIST | |
| I | 1201.90 | NIST | |
| I | Outlier 1207.60 | NIST | |
| I | 1184.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1190.00 | NIST | |
| I | 1178.00 | NIST | |
| I | 1175.00 | NIST | |
| I | 1183.00 | NIST | |
| I | 1181.00 | NIST | |
| I | 1184.00 | NIST | |
| I | 1175.00 | NIST | |
| I | 1173.00 | NIST | |
| I | 1173.00 | NIST | |
| I | 1193.00 | NIST | |
| I | 1193.00 | NIST | |
| I | Outlier 1213.00 | NIST | |
| I | 1173.00 | NIST | |
| I | 1173.00 | NIST | |
| I | 1174.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1200.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1178.00 | NIST | |
| I | 1182.00 | NIST | |
| I | 1172.00 | NIST | |
| I | 1183.00 | NIST | |
| I | 1173.00 | NIST | |
| I | 1189.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1186.00 | NIST | |
| I | 1185.00 | NIST | |
| I | Outlier 1208.00 | NIST | |
| I | 1182.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1183.00 | NIST | |
| I | 1161.00 | NIST | |
| I | 1162.00 | NIST | |
| I | 1178.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1179.00 | NIST | |
| I | Outlier 1145.00 | NIST | |
| I | 1178.00 | NIST | |
| I | 1178.00 | NIST | |
| I | 1194.00 | NIST | |
| I | 1195.00 | NIST | |
| I | 1171.00 | NIST | |
| I | 1183.00 | NIST | |
| I | 1184.00 | NIST | |
| I | 1188.00 | NIST | |
| I | 1172.00 | NIST | |
| I | 1160.00 | NIST | |
| I | 1174.00 | NIST | |
| I | 1181.00 | NIST | |
| I | 1187.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1188.00 | NIST | |
| I | 1187.00 | NIST | |
| I | 1189.00 | NIST | |
| I | 1201.00 | NIST | |
| I | 1198.00 | NIST | |
| I | 1193.00 | NIST | |
| I | 1183.00 | NIST | |
| I | 1178.00 | NIST | |
| I | 1191.00 | NIST | |
| I | 1188.00 | NIST | |
| I | 1172.00 | NIST | |
| I | 1173.00 | NIST | |
| I | 1207.00 | NIST | |
| I | 1199.00 | NIST | |
| I | 1198.00 | NIST | |
| I | 1206.00 | NIST | |
| I | 1194.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1179.00 | NIST | |
| I | Outlier 1154.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1158.00 | NIST | |
| I | 1171.00 | NIST | |
| I | 1174.00 | NIST | |
| I | 1181.00 | NIST | |
| I | 1191.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1191.00 | NIST | |
| I | 1182.00 | NIST | |
| I | 1189.00 | NIST | |
| I | 1188.00 | NIST | |
| I | 1192.00 | NIST | |
| I | 1192.00 | NIST | |
| I | 1175.00 | NIST | |
| I | 1165.00 | NIST | |
| I | 1164.00 | NIST | |
| I | 1200.00 | NIST | |
| I | 1205.00 | NIST | |
| I | 1205.00 | NIST | |
| I | 1206.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1191.00 | NIST | |
| I | 1200.00 | NIST | |
| I | 1179.00 | NIST | |
| I | 1184.00 | NIST | |
| I | 1181.00 | NIST | |
| I | 1177.00 | NIST | |
| I | 1198.00 | NIST | |
| I | 1160.00 | NIST | |
| I | 1160.00 | NIST | |
| I | 1183.00 | NIST | |
| I | 1169.00 | NIST | |
| I | 1188.00 | NIST | |
| I | 1191.00 | NIST | |
| I | 1178.00 | NIST | |
| I | 1190.00 | NIST | |
| I | 1199.00 | NIST | |
| I | 1178.00 | NIST | |
| I | 1171.00 | NIST | |
| I | Outlier 1151.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1158.00 | NIST | |
| I | 1168.00 | NIST | |
| I | 1172.00 | NIST | |
| I | 1160.00 | NIST | |
| I | 1160.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1158.00 | NIST | |
| I | 1158.00 | NIST | |
| I | 1172.00 | NIST | |
| I | 1187.00 | NIST | |
| I | 1176.00 | NIST | |
| I | 1177.00 | NIST | |
| I | 1190.00 | NIST | |
| I | 1170.00 | NIST | |
| I | Outlier 1216.00 | NIST | |
| I | 1183.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1190.00 | NIST | |
| I | 1195.00 | NIST | |
| I | 1189.00 | NIST | |
| I | 1189.00 | NIST | |
| I | 1191.00 | NIST | |
| I | 1178.00 | NIST | |
| I | 1177.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1188.00 | NIST | |
| I | 1172.00 | NIST | |
| I | 1172.00 | NIST | |
| I | 1160.00 | NIST | |
| I | 1170.00 | NIST | |
| I | 1172.00 | NIST | |
| I | 1173.00 | NIST | |
| I | 1192.00 | NIST | |
| I | 1192.00 | NIST | |
| I | 1196.00 | NIST | |
| I | 1172.00 | NIST | |
| I | 1182.00 | NIST | |
| I | 1160.00 | NIST | |
| I | 1158.00 | NIST | |
| I | 1192.00 | NIST | |
| I | 1176.00 | NIST | |
| I | 1174.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1177.00 | NIST | |
| I | 1180.00 | NIST | |
| I | 1194.00 | NIST | |
| I | 1183.00 | NIST | |
| I | 1173.00 | NIST | |
| I | 1185.00 | NIST | |
| I | 1179.00 | NIST | |
| I | 1195.00 | NIST | |
| I | 1172.00 | NIST | |
| Tboil | [417.15; 425.15] | K |
|
| Tboil | 424.20 | K | KDB |
| Tboil | 422.70 | K | NIST |
| Tboil | 424.60 | K | NIST |
| Tboil | 424.65 | K | NIST |
| Tboil | 423.65 ± 1.00 | K | NIST |
| Tboil | 424.00 ± 0.40 | K | NIST |
| Tboil | 424.00 ± 0.40 | K | NIST |
| Tboil | 424.15 ± 1.00 | K | NIST |
| Tboil | 423.65 ± 0.50 | K | NIST |
| Tboil | 424.15 ± 0.50 | K | NIST |
| Tboil | 424.18 ± 0.10 | K | NIST |
| Tboil | Outlier 418.15 ± 10.00 | K | NIST |
| Tboil | 425.15 ± 2.00 | K | NIST |
| Tboil | 421.95 ± 1.00 | K | NIST |
| Tboil | 422.90 ± 1.00 | K | NIST |
| Tboil | 423.65 ± 3.00 | K | NIST |
| Tboil | 423.40 ± 0.50 | K | NIST |
| Tboil | 423.15 ± 1.00 | K | NIST |
| Tboil | 424.40 ± 0.50 | K | NIST |
| Tboil | 423.40 ± 0.20 | K | NIST |
| Tboil | 421.65 ± 2.00 | K | NIST |
| Tboil | 420.65 ± 4.00 | K | NIST |
| Tboil | 424.25 ± 0.50 | K | NIST |
| Tboil | 423.65 ± 1.00 | K | NIST |
| Tboil | 422.00 ± 10.00 | K | NIST |
| Tboil | 423.56 ± 0.20 | K | NIST |
| Tboil | 424.60 ± 0.20 | K | NIST |
| Tboil | 424.65 ± 1.00 | K | NIST |
| Tboil | 424.15 ± 1.00 | K | NIST |
| Tboil | 422.15 ± 2.00 | K | NIST |
| Tboil | Outlier 417.65 ± 10.00 | K | NIST |
| Tboil | 423.15 ± 1.00 | K | NIST |
| Tboil | 424.65 ± 1.00 | K | NIST |
| Tboil | 424.15 ± 1.00 | K | NIST |
| Tboil | Outlier 417.15 ± 10.00 | K | NIST |
| Tc | [611.40; 611.50] | K |
|
| Tc | 611.50 | K | KDB |
| Tc | 611.40 ± 0.30 | K | NIST |
| Tc | 611.50 ± 0.40 | K | NIST |
| Tfus | [238.00; 238.15] | K |
|
| Tfus | 238.00 | K | KDB |
| Tfus | 238.15 | K | NIST |
| Vc | 0.433 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [215.46; 277.17] | J/mol×K | [413.43; 590.00] |
|
| Cp,gas | 215.46 | J/mol×K | 413.43 | Joback Calculated Property |
| Cp,gas | 226.81 | J/mol×K | 442.86 | Joback Calculated Property |
| Cp,gas | 237.73 | J/mol×K | 472.29 | Joback Calculated Property |
| Cp,gas | 248.21 | J/mol×K | 501.71 | Joback Calculated Property |
| Cp,gas | 258.27 | J/mol×K | 531.14 | Joback Calculated Property |
| Cp,gas | 267.92 | J/mol×K | 560.57 | Joback Calculated Property |
| Cp,gas | 277.17 | J/mol×K | 590.00 | Joback Calculated Property |
| η | [0.0003013; 0.0041439] | Pa×s | [218.58; 413.43] |
|
| η | 0.0041439 | Pa×s | 218.58 | Joback Calculated Property |
| η | 0.0020181 | Pa×s | 251.05 | Joback Calculated Property |
| η | 0.0011589 | Pa×s | 283.53 | Joback Calculated Property |
| η | 0.0007459 | Pa×s | 316.00 | Joback Calculated Property |
| η | 0.0005212 | Pa×s | 348.48 | Joback Calculated Property |
| η | 0.0003871 | Pa×s | 380.95 | Joback Calculated Property |
| η | 0.0003013 | Pa×s | 413.43 | Joback Calculated Property |
| ΔfusH | [19.71; 19.71] | kJ/mol | [237.70; 237.70] |
|
| ΔfusH | 19.71 | kJ/mol | 237.70 | NIST |
| ΔfusH | 19.71 | kJ/mol | 237.70 | NIST |
| ΔvapH | [39.10; 47.50] | kJ/mol | [363.50; 464.50] |
|
| ΔvapH | 47.50 | kJ/mol | 363.50 | NIST |
| ΔvapH | 44.70 | kJ/mol | 392.00 | NIST |
| ΔvapH | 39.50 | kJ/mol | 422.20 | NIST |
| ΔvapH | 39.10 | kJ/mol | 464.50 | NIST |
| Pvap | [9.87; 91.50] | kPa | [354.77; 420.20] |
|
| Pvap | 9.87 | kPa | 354.77 | Vapor L... |
| Pvap | 11.52 | kPa | 358.59 | Vapor L... |
| Pvap | 15.05 | kPa | 365.38 | Vapor L... |
| Pvap | 16.52 | kPa | 367.88 | Vapor L... |
| Pvap | 17.34 | kPa | 368.90 | Vapor L... |
| Pvap | 20.76 | kPa | 373.79 | Vapor L... |
| Pvap | 20.76 | kPa | 373.84 | Vapor L... |
| Pvap | 25.32 | kPa | 379.25 | Vapor L... |
| Pvap | 25.32 | kPa | 379.30 | Vapor L... |
| Pvap | 29.69 | kPa | 383.78 | Vapor L... |
| Pvap | 29.69 | kPa | 383.83 | Vapor L... |
| Pvap | 34.81 | kPa | 388.51 | Vapor L... |
| Pvap | 40.00 | kPa | 392.54 | Vapor L... |
| Pvap | 40.52 | kPa | 393.11 | Vapor L... |
| Pvap | 48.09 | kPa | 398.45 | Vapor L... |
| Pvap | 55.74 | kPa | 403.15 | Vapor L... |
| Pvap | 60.35 | kPa | 405.81 | Vapor L... |
| Pvap | 67.50 | kPa | 409.67 | Vapor L... |
| Pvap | 75.05 | kPa | 413.30 | Vapor L... |
| Pvap | 83.20 | kPa | 416.77 | Vapor L... |
| Pvap | 91.50 | kPa | 420.20 | Vapor L... |
| ρl | [798.22; 820.00] | kg/m3 | [288.00; 313.15] |
|
| ρl | 820.00 | kg/m3 | 288.00 | KDB |
| ρl | 819.79 | kg/m3 | 288.15 | Volumet... |
| ρl | 815.39 | kg/m3 | 293.15 | Thermod... |
| ρl | 815.50 | kg/m3 | 293.15 | Volumet... |
| ρl | 811.16 | kg/m3 | 298.15 | Thermod... |
| ρl | 811.08 | kg/m3 | 298.15 | Thermod... |
| ρl | 811.20 | kg/m3 | 298.15 | Volumet... |
| ρl | 811.16 | kg/m3 | 298.15 | Thermod... |
| ρl | 811.16 | kg/m3 | 298.15 | Thermod... |
| ρl | 806.89 | kg/m3 | 303.15 | Volumet... |
| ρl | 806.81 | kg/m3 | 303.15 | Thermod... |
| ρl | 802.56 | kg/m3 | 308.15 | Volumet... |
| ρl | 798.22 | kg/m3 | 313.15 | Volumet... |
| csound,fluid | [1244.14; 1281.92] | m/s | [293.15; 303.15] |
|
| csound,fluid | 1281.92 | m/s | 293.15 | Thermod... |
| csound,fluid | 1262.49 | m/s | 298.15 | Thermod... |
| csound,fluid | 1244.14 | m/s | 303.15 | Thermod... |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 384.20 | K | 2.80 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [316.84; 450.01] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.50362e+01 | |||
| Coefficient B | -3.80179e+03 | |||
| Coefficient C | -5.90720e+01 | |||
| Temperature range, min. | 316.84 | |||
| Temperature range, max. | 450.01 | |||
| Pvap | 1.33 | kPa | 316.84 | Calculated Property |
| Pvap | 2.97 | kPa | 331.64 | Calculated Property |
| Pvap | 6.09 | kPa | 346.43 | Calculated Property |
| Pvap | 11.64 | kPa | 361.23 | Calculated Property |
| Pvap | 20.94 | kPa | 376.03 | Calculated Property |
| Pvap | 35.75 | kPa | 390.82 | Calculated Property |
| Pvap | 58.31 | kPa | 405.62 | Calculated Property |
| Pvap | 91.38 | kPa | 420.42 | Calculated Property |
| Pvap | 138.23 | kPa | 435.21 | Calculated Property |
| Pvap | 202.64 | kPa | 450.01 | Calculated Property |
| Pvap | [3.08e-03; 2843.45] | kPa | [238.15; 611.55] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 1.02039e+02 | |||
| Coefficient B | -9.16636e+03 | |||
| Coefficient C | -1.27418e+01 | |||
| Coefficient D | 7.09544e-06 | |||
| Temperature range, min. | 238.15 | |||
| Temperature range, max. | 611.55 | |||
| Pvap | 3.08e-03 | kPa | 238.15 | Calculated Property |
| Pvap | 0.14 | kPa | 279.64 | Calculated Property |
| Pvap | 1.98 | kPa | 321.13 | Calculated Property |
| Pvap | 13.49 | kPa | 362.62 | Calculated Property |
| Pvap | 56.98 | kPa | 404.11 | Calculated Property |
| Pvap | 174.08 | kPa | 445.59 | Calculated Property |
| Pvap | 424.93 | kPa | 487.08 | Calculated Property |
| Pvap | 885.80 | kPa | 528.57 | Calculated Property |
| Pvap | 1651.12 | kPa | 570.06 | Calculated Property |
| Pvap | 2843.45 | kPa | 611.55 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Heptanone.
Mixtures
- 1-Pentanol + 2-Heptanone
- 1-Propanamine, N-propyl- + 2-Heptanone
- 1-Butanamine, N-butyl- + 2-Heptanone
- Triethylamine + 2-Heptanone
- Formamide, N,N-dimethyl- + 2-Heptanone
- Ethane, 1,2-dichloro- + 2-Heptanone
- 2-Heptanone + Ethane, 1,1,2,2-tetrachloro-
- 1-Octanol + 2-Heptanone
- 1-Decanol + 2-Heptanone
- 1-Dodecanol + 2-Heptanone
- Aniline + 2-Heptanone
- Aniline, N-methyl- + 2-Heptanone
- Octane + 2-Heptanone
- Nonane + 2-Heptanone
- Decane + 2-Heptanone
- 2-Heptanone + Water
- Sodium sulfate + 2-Heptanone + Water
- Propanamide, N,N-bis(2-ethylhexyl)-2-methyl- + 2-Heptanone
- sodium chloride + 2-Heptanone + Water
Sources
- KDB Vapor Pressure Data
- Crippen Method
- A relative headspace method for Henry s constants of volatile organic compounds
- Vapour liquid equilibria, azeotropic data, excess enthalpies, activity coefficients at infinite dilution and solid liquid equilibria for binary alcohol ketone systems
- Thermodynamics of ketone + amine mixtures. Part IX. Excess molar enthalpies at 298.15K for dipropylamine, or dibutylamine + 2-alkanone systems and modeling of linear or aromatic amine + 2-alkanone mixtures in terms of DISQUAC and ERAS
- Thermodynamics of ketone + amine mixtures. Part X. Excess molarenthalpies at 298.15 K for N,N,N-triethylamine + 2-alkanone systems.Characterization of tertiary amine + 2-alkanone, and ofamino-ketone + n-alkane mixtures in terms of DISQUAC
- A thermodynamic study of the ketoreductase-catalyzed reduction of 2-alkanones in non-aqueous solvents
- Solubility of fragrance raw materials in water: Experimental study, correlations, and Mod. UNIFAC (Do) predictions
- Thermodynamics of (ketone + amine) mixtures. Part VI. Volumetric and speed of sound data at (293.15, 298.15, and 303.15) K for (2-heptanone + dipropylamine, +dibutylamine, or +triethylamine) systems
- Thermodynamics of amide + ketone mixtures. 1. Volumetric, speed of sound and refractive index data for N,N-dimethylformamide + 2-alkanone systems at several temperatures
- Volumetric properties of binary liquid mixtures of ketones with chloroalkanes at different temperatures and atmospheric pressure
- Determination of Activity Coefficients at Infinite Dilution of Solutes in N,N'-Di(2-ethylhexyl)isobutyramide Using Inverse Gas-Liquid Chromatography
- Henry s Constants of 1-Alkanols and 2-Ketones in Salt Solutions
- Measurements, Correlations, and Mod. UNIFAC (Do) Prediction of (Solid-Liquid) Phase Equilibria Diagrams in Binary Systems (Aliphatic Ketone + an Alcohol)
- Thermodynamics of Ketone + Amine Mixtures. Part VIII. Molar Excess Enthalpies at 298.15 K for n-Alkanone + Aniline or + N-Methylaniline Systems
- Vapor Liquid Equilibria Measurements for the Nine n-Alkane/Ketone Pairs Comprising 2-, 3-, and 4-Heptanone with n-Octane, n-Nonane, and n-Decane
- Joback Method
- KDB
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.