- InChI
- InChI=1S/C14H28O/c1-4-6-7-8-9-10-11-12-14(15)13(3)5-2/h13H,4-12H2,1-3H3
- InChI Key
- MTDKYNCGFZGFIY-UHFFFAOYSA-N
- Formula
- C14H28O
- SMILES
- CCCCCCCCCC(=O)C(C)CC
- Molecular Weight1
- 212.37
- 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° | -64.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -450.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.12 | kJ/mol | Joback Calculated Property |
| log10WS | -4.72 | Crippen Calculated Property | |
| logPoct/wat | 4.742 | Crippen Calculated Property | |
| McVol | 209.690 | ml/mol | McGowan Calculated Property |
| Pc | 1611.58 | kPa | Joback Calculated Property |
| Inp | [1532.00; 1532.00] |
|
|
| Inp | 1532.00 | NIST | |
| Inp | 1532.00 | NIST | |
| Tboil | 573.15 | K | Joback Calculated Property |
| Tc | 744.08 | K | Joback Calculated Property |
| Tfus | 282.47 | K | Joback Calculated Property |
| Vc | 0.820 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [537.86; 632.08] | J/mol×K | [573.15; 744.08] |
|
| Cp,gas | 537.86 | J/mol×K | 573.15 | Joback Calculated Property |
| Cp,gas | 555.36 | J/mol×K | 601.64 | Joback Calculated Property |
| Cp,gas | 572.11 | J/mol×K | 630.13 | Joback Calculated Property |
| Cp,gas | 588.14 | J/mol×K | 658.62 | Joback Calculated Property |
| Cp,gas | 603.46 | J/mol×K | 687.10 | Joback Calculated Property |
| Cp,gas | 618.10 | J/mol×K | 715.59 | Joback Calculated Property |
| Cp,gas | 632.08 | J/mol×K | 744.08 | Joback Calculated Property |
| η | [0.0001809; 0.0056093] | Pa×s | [282.47; 573.15] |
|
| η | 0.0056093 | Pa×s | 282.47 | Joback Calculated Property |
| η | 0.0020815 | Pa×s | 330.92 | Joback Calculated Property |
| η | 0.0009950 | Pa×s | 379.36 | Joback Calculated Property |
| η | 0.0005621 | Pa×s | 427.81 | Joback Calculated Property |
| η | 0.0003567 | Pa×s | 476.26 | Joback Calculated Property |
| η | 0.0002462 | Pa×s | 524.70 | Joback Calculated Property |
| η | 0.0001809 | Pa×s | 573.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Methyltridecan-4-one.
Sources
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