- InChI
- InChI=1S/C24H29ClO4/c1-3-4-5-6-7-8-9-15-28-23(26)19-11-10-12-20(17-19)24(27)29-22-16-18(2)13-14-21(22)25/h10-14,16-17H,3-9,15H2,1-2H3
- InChI Key
- NROOPQQYCXXBEJ-UHFFFAOYSA-N
- Formula
- C24H29ClO4
- SMILES
-
CCCCCCCCCOC(=O)c1cccc(C(=O)Oc2
cc(C)ccc2Cl)c1 - Molecular Weight1
- 416.94
- 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° | -132.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -605.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.25 | kJ/mol | Joback Calculated Property |
| log10WS | -8.31 | Crippen Calculated Property | |
| logPoct/wat | 6.775 | Crippen Calculated Property | |
| McVol | 328.620 | ml/mol | McGowan Calculated Property |
| Pc | 1231.15 | kPa | Joback Calculated Property |
| Inp | [3164.00; 3164.00] |
|
|
| Inp | 3164.00 | NIST | |
| Inp | 3164.00 | NIST | |
| Tboil | 1006.83 | K | Joback Calculated Property |
| Tc | 1237.08 | K | Joback Calculated Property |
| Tfus | 624.88 | K | Joback Calculated Property |
| Vc | 1.260 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1037.08; 1093.16] | J/mol×K | [1006.83; 1237.08] |
|
| Cp,gas | 1037.08 | J/mol×K | 1006.83 | Joback Calculated Property |
| Cp,gas | 1049.89 | J/mol×K | 1045.20 | Joback Calculated Property |
| Cp,gas | 1061.25 | J/mol×K | 1083.58 | Joback Calculated Property |
| Cp,gas | 1071.22 | J/mol×K | 1121.95 | Joback Calculated Property |
| Cp,gas | 1079.83 | J/mol×K | 1160.33 | Joback Calculated Property |
| Cp,gas | 1087.13 | J/mol×K | 1198.70 | Joback Calculated Property |
| Cp,gas | 1093.16 | J/mol×K | 1237.08 | Joback Calculated Property |
| η | [0.0000284; 0.0002222] | Pa×s | [624.88; 1006.83] |
|
| η | 0.0002222 | Pa×s | 624.88 | Joback Calculated Property |
| η | 0.0001345 | Pa×s | 688.54 | Joback Calculated Property |
| η | 0.0000887 | Pa×s | 752.20 | Joback Calculated Property |
| η | 0.0000624 | Pa×s | 815.86 | Joback Calculated Property |
| η | 0.0000462 | Pa×s | 879.51 | Joback Calculated Property |
| η | 0.0000356 | Pa×s | 943.17 | Joback Calculated Property |
| η | 0.0000284 | Pa×s | 1006.83 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, 2-chloro-5-methylphenyl nonyl ester.
Sources
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