- InChI
- InChI=1S/C32H56O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26-35-31(33)22-21-23-32(34)36-30(27-29(4)5)25-24-28(2)3/h29-30H,2,6-23,26-27H2,1,3-5H3
- InChI Key
- LPDTVYUDPRLXGA-UHFFFAOYSA-N
- Formula
- C32H56O4
- SMILES
-
C=C(C)C#CC(CC(C)C)OC(=O)CCCC(=
O)OCCCCCCCCCCCCCCCCC - Molecular Weight1
- 504.78
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.2478 | Relay (... Calculated Property | |
| ΔfG° | 27.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -959.77 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 77.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 133.86 | kJ/mol | Relay (... Calculated Property |
| IE | 9.10 | eV | Relay (... Calculated Property |
| log10WS | -8.28 | Relay (... Calculated Property | |
| logPoct/wat | 9.109 | Crippen Calculated Property | |
| McVol | 463.720 | ml/mol | McGowan Calculated Property |
| Pc | 632.89 | kPa | Joback Calculated Property |
| Inp | 3387.00 | NIST | |
| Tboil | 684.61 | K | Relay (... Calculated Property |
| Tc | 863.21 | K | Relay (... Calculated Property |
| Tfus | 307.78 | K | Relay (... Calculated Property |
| Vc | 1.722 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1646.91; 1744.49] | J/mol×K | [1088.82; 1357.47] | 
|
| Cp,gas | 1646.91 | J/mol×K | 1088.82 | Joback Calculated Property |
| Cp,gas | 1668.59 | J/mol×K | 1133.60 | Joback Calculated Property |
| Cp,gas | 1687.94 | J/mol×K | 1178.37 | Joback Calculated Property |
| Cp,gas | 1705.07 | J/mol×K | 1223.15 | Joback Calculated Property |
| Cp,gas | 1720.12 | J/mol×K | 1267.92 | Joback Calculated Property |
| Cp,gas | 1733.22 | J/mol×K | 1312.70 | Joback Calculated Property |
| Cp,gas | 1744.49 | J/mol×K | 1357.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,7-dimethyloct-5-yn-7-en-4-yl heptadecyl ester.
Sources
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