- InChI
- InChI=1S/C19H36O2/c1-4-6-7-8-9-10-11-12-13-14-15-17-21-19(20)18(3)16-5-2/h5,18H,2,4,6-17H2,1,3H3
- InChI Key
- QHJVHHWMUTUGCA-UHFFFAOYSA-N
- Formula
- C19H36O2
- SMILES
- C=CCC(C)C(=O)OCCCCCCCCCCCCC
- Molecular Weight1
- 296.49
- 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° | -39.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -560.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.95 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.99 | kJ/mol | Joback Calculated Property |
| log10WS | -6.25 | Crippen Calculated Property | |
| logPoct/wat | 6.053 | Crippen Calculated Property | |
| McVol | 281.710 | ml/mol | McGowan Calculated Property |
| Pc | 1152.22 | kPa | Joback Calculated Property |
| Inp | [2011.00; 2011.00] |
|
|
| Inp | 2011.00 | NIST | |
| Inp | 2011.00 | NIST | |
| Tboil | 706.65 | K | Joback Calculated Property |
| Tc | 878.93 | K | Joback Calculated Property |
| Tfus | 359.29 | K | Joback Calculated Property |
| Vc | 1.099 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [824.36; 925.08] | J/mol×K | [706.65; 878.93] |
|
| Cp,gas | 824.36 | J/mol×K | 706.65 | Joback Calculated Property |
| Cp,gas | 843.28 | J/mol×K | 735.36 | Joback Calculated Property |
| Cp,gas | 861.31 | J/mol×K | 764.08 | Joback Calculated Property |
| Cp,gas | 878.48 | J/mol×K | 792.79 | Joback Calculated Property |
| Cp,gas | 894.82 | J/mol×K | 821.50 | Joback Calculated Property |
| Cp,gas | 910.34 | J/mol×K | 850.21 | Joback Calculated Property |
| Cp,gas | 925.08 | J/mol×K | 878.93 | Joback Calculated Property |
| η | [0.0000818; 0.0023051] | Pa×s | [359.29; 706.65] |
|
| η | 0.0023051 | Pa×s | 359.29 | Joback Calculated Property |
| η | 0.0008981 | Pa×s | 417.18 | Joback Calculated Property |
| η | 0.0004403 | Pa×s | 475.08 | Joback Calculated Property |
| η | 0.0002520 | Pa×s | 532.97 | Joback Calculated Property |
| η | 0.0001609 | Pa×s | 590.86 | Joback Calculated Property |
| η | 0.0001113 | Pa×s | 648.76 | Joback Calculated Property |
| η | 0.0000818 | Pa×s | 706.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Pentenoic acid, 2-methyl-, tridecyl ester.
Sources
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