- InChI
- InChI=1S/C18H22Cl4O4/c1-11(2)6-5-9-25-14(23)7-3-4-8-15(24)26-18-16(21)12(19)10-13(20)17(18)22/h10-11H,3-9H2,1-2H3
- InChI Key
- OOWKGQXZLINJFL-UHFFFAOYSA-N
- Formula
- C18H22Cl4O4
- SMILES
-
CC(C)CCCOC(=O)CCCCC(=O)Oc1c(Cl
)c(Cl)cc(Cl)c1Cl - Molecular Weight1
- 444.18
- 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° | -343.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -782.04 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.05 | kJ/mol | Joback Calculated Property |
| log10WS | -7.33 | Crippen Calculated Property | |
| logPoct/wat | 6.745 | Crippen Calculated Property | |
| McVol | 304.560 | ml/mol | McGowan Calculated Property |
| Pc | 1348.67 | kPa | Joback Calculated Property |
| Inp | [2839.00; 2839.00] |
|
|
| Inp | 2839.00 | NIST | |
| Inp | 2839.00 | NIST | |
| Tboil | 959.70 | K | Joback Calculated Property |
| Tc | 1182.94 | K | Joback Calculated Property |
| Tfus | 618.12 | K | Joback Calculated Property |
| Vc | 1.173 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [854.34; 901.06] | J/mol×K | [959.70; 1182.94] |
|
| Cp,gas | 854.34 | J/mol×K | 959.70 | Joback Calculated Property |
| Cp,gas | 865.10 | J/mol×K | 996.91 | Joback Calculated Property |
| Cp,gas | 874.65 | J/mol×K | 1034.11 | Joback Calculated Property |
| Cp,gas | 883.01 | J/mol×K | 1071.32 | Joback Calculated Property |
| Cp,gas | 890.19 | J/mol×K | 1108.52 | Joback Calculated Property |
| Cp,gas | 896.21 | J/mol×K | 1145.73 | Joback Calculated Property |
| Cp,gas | 901.06 | J/mol×K | 1182.94 | Joback Calculated Property |
| η | [0.0000376; 0.0002506] | Pa×s | [618.12; 959.70] |
|
| η | 0.0002506 | Pa×s | 618.12 | Joback Calculated Property |
| η | 0.0001599 | Pa×s | 675.05 | Joback Calculated Property |
| η | 0.0001094 | Pa×s | 731.98 | Joback Calculated Property |
| η | 0.0000791 | Pa×s | 788.91 | Joback Calculated Property |
| η | 0.0000597 | Pa×s | 845.84 | Joback Calculated Property |
| η | 0.0000467 | Pa×s | 902.77 | Joback Calculated Property |
| η | 0.0000376 | Pa×s | 959.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, isohexyl 2,3,5,6-tetrachlorophenyl ester.
Sources
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