- InChI
- InChI=1S/C24H30O4/c1-4-5-6-7-10-16-27-23(25)19-12-11-13-20(17-19)24(26)28-22-15-9-8-14-21(22)18(2)3/h8-9,11-15,17-18H,4-7,10,16H2,1-3H3
- InChI Key
- MWIAAEGQVJPIFM-UHFFFAOYSA-N
- Formula
- C24H30O4
- SMILES
-
CCCCCCCOC(=O)c1cccc(C(=O)Oc2cc
ccc2C(C)C)c1 - Molecular Weight1
- 382.49
- 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° | -113.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -583.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.82 | kJ/mol | Joback Calculated Property |
| log10WS | -7.50 | Crippen Calculated Property | |
| logPoct/wat | 6.156 | Crippen Calculated Property | |
| McVol | 316.380 | ml/mol | McGowan Calculated Property |
| Pc | 1284.67 | kPa | Joback Calculated Property |
| Inp | [2918.00; 2918.00] |
|
|
| Inp | 2918.00 | NIST | |
| Inp | 2918.00 | NIST | |
| Tboil | 963.98 | K | Joback Calculated Property |
| Tc | 1189.04 | K | Joback Calculated Property |
| Tfus | 567.44 | K | Joback Calculated Property |
| Vc | 1.206 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1016.14; 1081.66] | J/mol×K | [963.98; 1189.04] |
|
| Cp,gas | 1016.14 | J/mol×K | 963.98 | Joback Calculated Property |
| Cp,gas | 1030.50 | J/mol×K | 1001.49 | Joback Calculated Property |
| Cp,gas | 1043.42 | J/mol×K | 1039.00 | Joback Calculated Property |
| Cp,gas | 1054.95 | J/mol×K | 1076.51 | Joback Calculated Property |
| Cp,gas | 1065.14 | J/mol×K | 1114.02 | Joback Calculated Property |
| Cp,gas | 1074.03 | J/mol×K | 1151.53 | Joback Calculated Property |
| Cp,gas | 1081.66 | J/mol×K | 1189.04 | Joback Calculated Property |
| η | [0.0000296; 0.0003262] | Pa×s | [567.44; 963.98] |
|
| η | 0.0003262 | Pa×s | 567.44 | Joback Calculated Property |
| η | 0.0001776 | Pa×s | 633.53 | Joback Calculated Property |
| η | 0.0001084 | Pa×s | 699.62 | Joback Calculated Property |
| η | 0.0000721 | Pa×s | 765.71 | Joback Calculated Property |
| η | 0.0000511 | Pa×s | 831.80 | Joback Calculated Property |
| η | 0.0000381 | Pa×s | 897.89 | Joback Calculated Property |
| η | 0.0000296 | Pa×s | 963.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, heptyl 2-isopropylphenyl ester.
Sources
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