- InChI
- InChI=1S/C23H26Cl2O4/c1-2-3-4-5-6-7-8-12-28-22(26)17-10-9-11-18(13-17)23(27)29-21-15-19(24)14-20(25)16-21/h9-11,13-16H,2-8,12H2,1H3
- InChI Key
- WNVCQVCTVQSTCT-UHFFFAOYSA-N
- Formula
- C23H26Cl2O4
- SMILES
-
CCCCCCCCCOC(=O)c1cccc(C(=O)Oc2
cc(Cl)cc(Cl)c2)c1 - Molecular Weight1
- 437.36
- 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° | -152.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -600.48 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 56.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.41 | kJ/mol | Joback Calculated Property |
| log10WS | -8.52 | Crippen Calculated Property | |
| logPoct/wat | 7.120 | Crippen Calculated Property | |
| McVol | 326.770 | ml/mol | McGowan Calculated Property |
| Pc | 1283.75 | kPa | Joback Calculated Property |
| Inp | [3243.00; 3243.00] |
|
|
| Inp | 3243.00 | NIST | |
| Inp | 3243.00 | NIST | |
| Tboil | 1021.38 | K | Joback Calculated Property |
| Tc | 1255.57 | K | Joback Calculated Property |
| Tfus | 643.53 | K | Joback Calculated Property |
| Vc | 1.254 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [998.18; 1046.53] | J/mol×K | [1021.38; 1255.57] |
|
| Cp,gas | 998.18 | J/mol×K | 1021.38 | Joback Calculated Property |
| Cp,gas | 1009.59 | J/mol×K | 1060.41 | Joback Calculated Property |
| Cp,gas | 1019.59 | J/mol×K | 1099.44 | Joback Calculated Property |
| Cp,gas | 1028.24 | J/mol×K | 1138.48 | Joback Calculated Property |
| Cp,gas | 1035.58 | J/mol×K | 1177.51 | Joback Calculated Property |
| Cp,gas | 1041.66 | J/mol×K | 1216.54 | Joback Calculated Property |
| Cp,gas | 1046.53 | J/mol×K | 1255.57 | Joback Calculated Property |
| η | [0.0000278; 0.0002042] | Pa×s | [643.53; 1021.38] |
|
| η | 0.0002042 | Pa×s | 643.53 | Joback Calculated Property |
| η | 0.0001263 | Pa×s | 706.50 | Joback Calculated Property |
| η | 0.0000845 | Pa×s | 769.48 | Joback Calculated Property |
| η | 0.0000601 | Pa×s | 832.45 | Joback Calculated Property |
| η | 0.0000448 | Pa×s | 895.43 | Joback Calculated Property |
| η | 0.0000348 | Pa×s | 958.40 | Joback Calculated Property |
| η | 0.0000278 | Pa×s | 1021.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, 3,5-dichlorophenyl nonyl ester.
Sources
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