- InChI
- InChI=1S/C8H14O/c1-3-4-5-6-7-8(2)9/h3H,1,4-7H2,2H3
- InChI Key
- RXHCEQYNSQNEOK-UHFFFAOYSA-N
- Formula
- C8H14O
- SMILES
- C=CCCCCC(C)=O
- Molecular Weight1
- 126.20
- CAS
- 3664-60-6
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (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 |
|---|---|---|---|
| ΔfG° | -24.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -195.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.48 | kJ/mol | Joback Calculated Property |
| log10WS | -2.30 | Crippen Calculated Property | |
| logPoct/wat | 2.322 | Crippen Calculated Property | |
| McVol | 120.850 | ml/mol | McGowan Calculated Property |
| Pc | 2826.33 | kPa | Joback Calculated Property |
| Inp | 1097.00 | NIST | |
| Tboil | 432.99 | K | Joback Calculated Property |
| Tc | 611.99 | K | Joback Calculated Property |
| Tfus | 228.09 | K | Joback Calculated Property |
| Vc | 0.470 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [239.51; 303.57] | J/mol×K | [432.99; 611.99] | 
|
| Cp,gas | 239.51 | J/mol×K | 432.99 | Joback Calculated Property |
| Cp,gas | 251.42 | J/mol×K | 462.82 | Joback Calculated Property |
| Cp,gas | 262.81 | J/mol×K | 492.66 | Joback Calculated Property |
| Cp,gas | 273.71 | J/mol×K | 522.49 | Joback Calculated Property |
| Cp,gas | 284.13 | J/mol×K | 552.32 | Joback Calculated Property |
| Cp,gas | 294.08 | J/mol×K | 582.16 | Joback Calculated Property |
| Cp,gas | 303.57 | J/mol×K | 611.99 | Joback Calculated Property |
| η | [0.0002930; 0.0038763] | Pa×s | [228.09; 432.99] |
|
| η | 0.0038763 | Pa×s | 228.09 | Joback Calculated Property |
| η | 0.0019045 | Pa×s | 262.24 | Joback Calculated Property |
| η | 0.0011022 | Pa×s | 296.39 | Joback Calculated Property |
| η | 0.0007142 | Pa×s | 330.54 | Joback Calculated Property |
| η | 0.0005020 | Pa×s | 364.69 | Joback Calculated Property |
| η | 0.0003748 | Pa×s | 398.84 | Joback Calculated Property |
| η | 0.0002930 | Pa×s | 432.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 7-Octen-2-one.
Sources
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