- InChI
- InChI=1S/C24H38O4/c1-6-7-8-9-10-11-12-13-17-27-22(25)20-15-14-16-21(18-20)23(26)28-19(2)24(3,4)5/h14-16,18-19H,6-13,17H2,1-5H3
- InChI Key
- PUMSPAVLFXGOFB-UHFFFAOYSA-N
- Formula
- C24H38O4
- SMILES
-
CCCCCCCCCCOC(=O)c1cccc(C(=O)OC
(C)C(C)(C)C)c1 - Molecular Weight1
- 390.56
- 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° | -213.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -817.26 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.58 | kJ/mol | Joback Calculated Property |
| log10WS | -7.69 | Crippen Calculated Property | |
| logPoct/wat | 6.575 | Crippen Calculated Property | |
| McVol | 340.140 | ml/mol | McGowan Calculated Property |
| Pc | 1049.37 | kPa | Joback Calculated Property |
| Inp | [2690.00; 2690.00] |
|
|
| Inp | 2690.00 | NIST | |
| Inp | 2690.00 | NIST | |
| Tboil | 929.09 | K | Joback Calculated Property |
| Tc | 1140.66 | K | Joback Calculated Property |
| Tfus | 530.92 | K | Joback Calculated Property |
| Vc | 1.302 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1120.03; 1203.78] | J/mol×K | [929.09; 1140.66] |
|
| Cp,gas | 1120.03 | J/mol×K | 929.09 | Joback Calculated Property |
| Cp,gas | 1137.08 | J/mol×K | 964.35 | Joback Calculated Property |
| Cp,gas | 1152.82 | J/mol×K | 999.61 | Joback Calculated Property |
| Cp,gas | 1167.30 | J/mol×K | 1034.87 | Joback Calculated Property |
| Cp,gas | 1180.59 | J/mol×K | 1070.14 | Joback Calculated Property |
| Cp,gas | 1192.72 | J/mol×K | 1105.40 | Joback Calculated Property |
| Cp,gas | 1203.78 | J/mol×K | 1140.66 | Joback Calculated Property |
| η | [0.0000216; 0.0003846] | Pa×s | [530.92; 929.09] |
|
| η | 0.0003846 | Pa×s | 530.92 | Joback Calculated Property |
| η | 0.0001823 | Pa×s | 597.28 | Joback Calculated Property |
| η | 0.0001003 | Pa×s | 663.64 | Joback Calculated Property |
| η | 0.0000616 | Pa×s | 730.00 | Joback Calculated Property |
| η | 0.0000410 | Pa×s | 796.37 | Joback Calculated Property |
| η | 0.0000290 | Pa×s | 862.73 | Joback Calculated Property |
| η | 0.0000216 | Pa×s | 929.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, decyl 3,3-dimethylbut-2-yl ester.
Sources
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