- InChI
- InChI=1S/C23H44O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-23(24)22(3)20-5-2/h5,22H,2,4,6-21H2,1,3H3
- InChI Key
- BQNQFBBQCNZZGY-UHFFFAOYSA-N
- Formula
- C23H44O2
- SMILES
-
C=CCC(C)C(=O)OCCCCCCCCCCCCCCCC
C - Molecular Weight1
- 352.59
- 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° | -5.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -642.70 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.31 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.89 | kJ/mol | Joback Calculated Property |
| log10WS | -7.92 | Crippen Calculated Property | |
| logPoct/wat | 7.613 | Crippen Calculated Property | |
| McVol | 338.070 | ml/mol | McGowan Calculated Property |
| Pc | 901.80 | kPa | Joback Calculated Property |
| Inp | [2414.00; 2414.00] |
|
|
| Inp | 2414.00 | NIST | |
| Inp | 2414.00 | NIST | |
| Tboil | 798.17 | K | Joback Calculated Property |
| Tc | 978.88 | K | Joback Calculated Property |
| Tfus | 404.37 | K | Joback Calculated Property |
| Vc | 1.323 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1066.85; 1175.06] | J/mol×K | [798.17; 978.88] |
|
| Cp,gas | 1066.85 | J/mol×K | 798.17 | Joback Calculated Property |
| Cp,gas | 1087.44 | J/mol×K | 828.29 | Joback Calculated Property |
| Cp,gas | 1106.95 | J/mol×K | 858.41 | Joback Calculated Property |
| Cp,gas | 1125.44 | J/mol×K | 888.52 | Joback Calculated Property |
| Cp,gas | 1142.93 | J/mol×K | 918.64 | Joback Calculated Property |
| Cp,gas | 1159.46 | J/mol×K | 948.76 | Joback Calculated Property |
| Cp,gas | 1175.06 | J/mol×K | 978.88 | Joback Calculated Property |
| η | [0.0000473; 0.0014720] | Pa×s | [404.37; 798.17] |
|
| η | 0.0014720 | Pa×s | 404.37 | Joback Calculated Property |
| η | 0.0005564 | Pa×s | 470.00 | Joback Calculated Property |
| η | 0.0002670 | Pa×s | 535.64 | Joback Calculated Property |
| η | 0.0001504 | Pa×s | 601.27 | Joback Calculated Property |
| η | 0.0000948 | Pa×s | 666.90 | Joback Calculated Property |
| η | 0.0000649 | Pa×s | 732.54 | Joback Calculated Property |
| η | 0.0000473 | Pa×s | 798.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Pentenoic acid, 2-methyl-, heptadecyl ester.
Sources
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