- InChI
- InChI=1S/C26H44O4/c1-3-5-7-9-11-12-13-14-16-18-20-24-30-26(28)22-21-25(27)29-23-19-17-15-10-8-6-4-2/h15,17H,3-14,16,19,21-24H2,1-2H3/b17-15+
- InChI Key
- CSRYTSWYKJKQNC-BMRADRMJSA-N
- Formula
- C26H44O4
- SMILES
-
CCCCCC=CCCOC(=O)CCC(=O)OCC#CCC
CCCCCCCC - Molecular Weight1
- 420.63
- 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° | -16.78 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -680.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 71.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.89 | kJ/mol | Joback Calculated Property |
| log10WS | -8.08 | Crippen Calculated Property | |
| logPoct/wat | 6.914 | Crippen Calculated Property | |
| McVol | 379.180 | ml/mol | McGowan Calculated Property |
| Pc | 859.99 | kPa | Joback Calculated Property |
| Inp | 2994.00 | NIST | |
| Tboil | 960.02 | K | Joback Calculated Property |
| Tc | 1176.26 | K | Joback Calculated Property |
| Tfus | 628.12 | K | Joback Calculated Property |
| Vc | 1.482 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1262.91; 1357.87] | J/mol×K | [960.02; 1176.26] | 
|
| Cp,gas | 1262.91 | J/mol×K | 960.02 | Joback Calculated Property |
| Cp,gas | 1282.02 | J/mol×K | 996.06 | Joback Calculated Property |
| Cp,gas | 1299.75 | J/mol×K | 1032.10 | Joback Calculated Property |
| Cp,gas | 1316.14 | J/mol×K | 1068.14 | Joback Calculated Property |
| Cp,gas | 1331.25 | J/mol×K | 1104.18 | Joback Calculated Property |
| Cp,gas | 1345.14 | J/mol×K | 1140.22 | Joback Calculated Property |
| Cp,gas | 1357.87 | J/mol×K | 1176.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, tridec-2-yn-1-yl non-3-en-1-yl ester.
Sources
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