- InChI
- InChI=1S/C20H10Cl4O4/c21-13-4-6-15(23)17(9-13)27-19(25)11-2-1-3-12(8-11)20(26)28-18-10-14(22)5-7-16(18)24/h1-10H
- InChI Key
- DSTHVSBCGVVTRH-UHFFFAOYSA-N
- Formula
- C20H10Cl4O4
- SMILES
-
O=C(Oc1cc(Cl)ccc1Cl)c1cccc(C(=
O)Oc2cc(Cl)ccc2Cl)c1 - Molecular Weight1
- 456.10
- 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° | -108.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -356.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.10 | kJ/mol | Joback Calculated Property |
| log10WS | -8.39 | Crippen Calculated Property | |
| logPoct/wat | 6.739 | Crippen Calculated Property | |
| McVol | 285.220 | ml/mol | McGowan Calculated Property |
| Pc | 1930.44 | kPa | Joback Calculated Property |
| Inp | [3525.00; 3525.00] |
|
|
| Inp | 3525.00 | NIST | |
| Inp | 3525.00 | NIST | |
| Tboil | 1064.24 | K | Joback Calculated Property |
| Tc | 1332.44 | K | Joback Calculated Property |
| Tfus | 721.02 | K | Joback Calculated Property |
| Vc | 1.075 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [738.89; 752.38] | J/mol×K | [1064.24; 1332.44] |
|
| Cp,gas | 738.89 | J/mol×K | 1064.24 | Joback Calculated Property |
| Cp,gas | 744.33 | J/mol×K | 1108.94 | Joback Calculated Property |
| Cp,gas | 748.36 | J/mol×K | 1153.64 | Joback Calculated Property |
| Cp,gas | 751.01 | J/mol×K | 1198.34 | Joback Calculated Property |
| Cp,gas | 752.34 | J/mol×K | 1243.04 | Joback Calculated Property |
| Cp,gas | 752.38 | J/mol×K | 1287.74 | Joback Calculated Property |
| Cp,gas | 751.20 | J/mol×K | 1332.44 | Joback Calculated Property |
| η | [0.0000343; 0.0001611] | Pa×s | [721.02; 1064.24] |
|
| η | 0.0001611 | Pa×s | 721.02 | Joback Calculated Property |
| η | 0.0001132 | Pa×s | 778.22 | Joback Calculated Property |
| η | 0.0000835 | Pa×s | 835.43 | Joback Calculated Property |
| η | 0.0000641 | Pa×s | 892.63 | Joback Calculated Property |
| η | 0.0000507 | Pa×s | 949.83 | Joback Calculated Property |
| η | 0.0000412 | Pa×s | 1007.04 | Joback Calculated Property |
| η | 0.0000343 | Pa×s | 1064.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, di(2,5-dichlorophenyl) ester.
Sources
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