- InChI
- InChI=1S/C29H50O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-23-32-28(30)19-18-20-29(31)33-27(24-26(4)5)22-21-25(2)3/h26-27H,2,6-20,23-24H2,1,3-5H3
- InChI Key
- ZHZHXNTZLZZDPT-UHFFFAOYSA-N
- Formula
- C29H50O4
- SMILES
-
C=C(C)C#CC(CC(C)C)OC(=O)CCCC(=
O)OCCCCCCCCCCCCCC - Molecular Weight1
- 462.70
- Cp,gas : Ideal gas heat capacity (J/mol×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).
- 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° | 2.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -754.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 69.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.25 | kJ/mol | Joback Calculated Property |
| log10WS | -9.21 | Crippen Calculated Property | |
| logPoct/wat | 7.938 | Crippen Calculated Property | |
| McVol | 421.450 | ml/mol | McGowan Calculated Property |
| Pc | 735.62 | kPa | Joback Calculated Property |
| Inp | 3071.00 | NIST | |
| Tboil | 1020.18 | K | Joback Calculated Property |
| Tc | 1255.40 | K | Joback Calculated Property |
| Tfus | 621.29 | K | Joback Calculated Property |
| Vc | 1.639 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1452.74; 1547.63] | J/mol×K | [1020.18; 1255.40] | 
|
| Cp,gas | 1452.74 | J/mol×K | 1020.18 | Joback Calculated Property |
| Cp,gas | 1472.83 | J/mol×K | 1059.38 | Joback Calculated Property |
| Cp,gas | 1491.10 | J/mol×K | 1098.59 | Joback Calculated Property |
| Cp,gas | 1507.65 | J/mol×K | 1137.79 | Joback Calculated Property |
| Cp,gas | 1522.54 | J/mol×K | 1176.99 | Joback Calculated Property |
| Cp,gas | 1535.84 | J/mol×K | 1216.20 | Joback Calculated Property |
| Cp,gas | 1547.63 | J/mol×K | 1255.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl tetradecyl ester.
Sources
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