- InChI
- InChI=1S/C20H26Cl4O4/c1-2-3-4-5-6-9-12-27-16(25)10-7-8-11-17(26)28-20-15(22)13-14(21)18(23)19(20)24/h13H,2-12H2,1H3
- InChI Key
- LFMGPCYJMDMKDU-UHFFFAOYSA-N
- Formula
- C20H26Cl4O4
- SMILES
-
CCCCCCCCOC(=O)CCCCC(=O)Oc1c(Cl
)cc(Cl)c(Cl)c1Cl - Molecular Weight1
- 472.23
- 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° | -324.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -818.04 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 62.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.89 | kJ/mol | Joback Calculated Property |
| log10WS | -8.41 | Crippen Calculated Property | |
| logPoct/wat | 7.670 | Crippen Calculated Property | |
| McVol | 332.740 | ml/mol | McGowan Calculated Property |
| Pc | 1170.42 | kPa | Joback Calculated Property |
| Inp | [3118.00; 3118.00] |
|
|
| Inp | 3118.00 | NIST | |
| Inp | 3118.00 | NIST | |
| Tboil | 1005.90 | K | Joback Calculated Property |
| Tc | 1232.79 | K | Joback Calculated Property |
| Tfus | 655.66 | K | Joback Calculated Property |
| Vc | 1.292 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [970.43; 1017.62] | J/mol×K | [1005.90; 1232.79] |
|
| Cp,gas | 970.43 | J/mol×K | 1005.90 | Joback Calculated Property |
| Cp,gas | 981.50 | J/mol×K | 1043.72 | Joback Calculated Property |
| Cp,gas | 991.27 | J/mol×K | 1081.53 | Joback Calculated Property |
| Cp,gas | 999.74 | J/mol×K | 1119.35 | Joback Calculated Property |
| Cp,gas | 1006.95 | J/mol×K | 1157.16 | Joback Calculated Property |
| Cp,gas | 1012.90 | J/mol×K | 1194.98 | Joback Calculated Property |
| Cp,gas | 1017.62 | J/mol×K | 1232.79 | Joback Calculated Property |
| η | [0.0000305; 0.0001897] | Pa×s | [655.66; 1005.90] |
|
| η | 0.0001897 | Pa×s | 655.66 | Joback Calculated Property |
| η | 0.0001235 | Pa×s | 714.03 | Joback Calculated Property |
| η | 0.0000858 | Pa×s | 772.41 | Joback Calculated Property |
| η | 0.0000627 | Pa×s | 830.78 | Joback Calculated Property |
| η | 0.0000478 | Pa×s | 889.15 | Joback Calculated Property |
| η | 0.0000376 | Pa×s | 947.53 | Joback Calculated Property |
| η | 0.0000305 | Pa×s | 1005.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, octyl 2,3,4,6-tetrachlorophenyl ester.
Sources
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