- InChI
- InChI=1S/C24H37ClO4/c1-20(2)13-12-18-29-24(27)22-15-11-14-21(19-22)23(26)28-17-10-8-6-4-3-5-7-9-16-25/h11,14-15,19-20H,3-10,12-13,16-18H2,1-2H3
- InChI Key
- AZVFSAKVZVWIDY-UHFFFAOYSA-N
- Formula
- C24H37ClO4
- SMILES
-
CC(C)CCCOC(=O)c1cccc(C(=O)OCCC
CCCCCCCCl)c1 - Molecular Weight1
- 425.00
- 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° | -228.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -824.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 57.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.26 | kJ/mol | Joback Calculated Property |
| log10WS | -7.73 | Crippen Calculated Property | |
| logPoct/wat | 6.796 | Crippen Calculated Property | |
| McVol | 352.380 | ml/mol | McGowan Calculated Property |
| Pc | 1012.30 | kPa | Joback Calculated Property |
| Inp | [3141.00; 3141.00] |
|
|
| Inp | 3141.00 | NIST | |
| Inp | 3141.00 | NIST | |
| Tboil | 969.75 | K | Joback Calculated Property |
| Tc | 1187.41 | K | Joback Calculated Property |
| Tfus | 558.42 | K | Joback Calculated Property |
| Vc | 1.363 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1146.50; 1221.01] | J/mol×K | [969.75; 1187.41] |
|
| Cp,gas | 1146.50 | J/mol×K | 969.75 | Joback Calculated Property |
| Cp,gas | 1162.32 | J/mol×K | 1006.03 | Joback Calculated Property |
| Cp,gas | 1176.72 | J/mol×K | 1042.30 | Joback Calculated Property |
| Cp,gas | 1189.75 | J/mol×K | 1078.58 | Joback Calculated Property |
| Cp,gas | 1201.44 | J/mol×K | 1114.86 | Joback Calculated Property |
| Cp,gas | 1211.85 | J/mol×K | 1151.14 | Joback Calculated Property |
| Cp,gas | 1221.01 | J/mol×K | 1187.41 | Joback Calculated Property |
| η | [0.0000237; 0.0003376] | Pa×s | [558.42; 969.75] |
|
| η | 0.0003376 | Pa×s | 558.42 | Joback Calculated Property |
| η | 0.0001702 | Pa×s | 626.98 | Joback Calculated Property |
| η | 0.0000982 | Pa×s | 695.53 | Joback Calculated Property |
| η | 0.0000625 | Pa×s | 764.09 | Joback Calculated Property |
| η | 0.0000429 | Pa×s | 832.64 | Joback Calculated Property |
| η | 0.0000312 | Pa×s | 901.19 | Joback Calculated Property |
| η | 0.0000237 | Pa×s | 969.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, 10-chlorodecyl isohexyl ester.
Sources
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