- InChI
- InChI=1S/C24H34O4/c25-23(27-16-14-19-8-3-1-4-9-19)21-12-7-13-22(18-21)24(26)28-17-15-20-10-5-2-6-11-20/h7,12-13,18-20H,1-6,8-11,14-17H2
- InChI Key
- ZOLLWCITYOPDLK-UHFFFAOYSA-N
- Formula
- C24H34O4
- SMILES
-
O=C(OCCC1CCCCC1)c1cccc(C(=O)OC
CC2CCCCC2)c1 - Molecular Weight1
- 386.52
- 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° | -164.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -694.59 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.13 | kJ/mol | Joback Calculated Property |
| log10WS | -7.12 | Crippen Calculated Property | |
| logPoct/wat | 5.941 | Crippen Calculated Property | |
| McVol | 318.420 | ml/mol | McGowan Calculated Property |
| Pc | 1367.69 | kPa | Joback Calculated Property |
| Inp | [3222.00; 3222.00] |
|
|
| Inp | 3222.00 | NIST | |
| Inp | 3222.00 | NIST | |
| Tboil | 971.86 | K | Joback Calculated Property |
| Tc | 1208.22 | K | Joback Calculated Property |
| Tfus | 558.26 | K | Joback Calculated Property |
| Vc | 1.185 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1109.09; 1179.79] | J/mol×K | [971.86; 1208.22] |
|
| Cp,gas | 1109.09 | J/mol×K | 971.86 | Joback Calculated Property |
| Cp,gas | 1125.66 | J/mol×K | 1011.25 | Joback Calculated Property |
| Cp,gas | 1140.24 | J/mol×K | 1050.65 | Joback Calculated Property |
| Cp,gas | 1152.88 | J/mol×K | 1090.04 | Joback Calculated Property |
| Cp,gas | 1163.64 | J/mol×K | 1129.43 | Joback Calculated Property |
| Cp,gas | 1172.60 | J/mol×K | 1168.83 | Joback Calculated Property |
| Cp,gas | 1179.79 | J/mol×K | 1208.22 | Joback Calculated Property |
| η | [0.0000325; 0.0004818] | Pa×s | [558.26; 971.86] |
|
| η | 0.0004818 | Pa×s | 558.26 | Joback Calculated Property |
| η | 0.0002401 | Pa×s | 627.19 | Joback Calculated Property |
| η | 0.0001373 | Pa×s | 696.13 | Joback Calculated Property |
| η | 0.0000869 | Pa×s | 765.06 | Joback Calculated Property |
| η | 0.0000593 | Pa×s | 833.99 | Joback Calculated Property |
| η | 0.0000429 | Pa×s | 902.93 | Joback Calculated Property |
| η | 0.0000325 | Pa×s | 971.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, di(2-cyclohexylethyl) ester.
Sources
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