- InChI
- InChI=1S/C23H40O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-20-26-22(24)18-17-19-23(25)27-21(3)5-2/h2,21H,4,6-20H2,1,3H3
- InChI Key
- HUDNVSSLASIIQU-UHFFFAOYSA-N
- Formula
- C23H40O4
- SMILES
-
C#CC(C)OC(=O)CCCC(=O)OCCCCCCCC
CCCCCC - Molecular Weight1
- 380.56
- 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° | -104.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -721.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 60.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.57 | kJ/mol | Joback Calculated Property |
| log10WS | -7.08 | Crippen Calculated Property | |
| logPoct/wat | 5.966 | Crippen Calculated Property | |
| McVol | 341.210 | ml/mol | McGowan Calculated Property |
| Pc | 990.13 | kPa | Joback Calculated Property |
| Inp | 2622.00 | NIST | |
| Tboil | 867.90 | K | Joback Calculated Property |
| Tc | 1063.14 | K | Joback Calculated Property |
| Tfus | 525.26 | K | Joback Calculated Property |
| Vc | 1.327 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1096.15; 1189.75] | J/mol×K | [867.90; 1063.14] | 
|
| Cp,gas | 1096.15 | J/mol×K | 867.90 | Joback Calculated Property |
| Cp,gas | 1114.58 | J/mol×K | 900.44 | Joback Calculated Property |
| Cp,gas | 1131.84 | J/mol×K | 932.98 | Joback Calculated Property |
| Cp,gas | 1147.95 | J/mol×K | 965.52 | Joback Calculated Property |
| Cp,gas | 1162.96 | J/mol×K | 998.06 | Joback Calculated Property |
| Cp,gas | 1176.88 | J/mol×K | 1030.60 | Joback Calculated Property |
| Cp,gas | 1189.75 | J/mol×K | 1063.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, but-3-yn-2-yl tetradecyl ester.
Sources
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