- InChI
- InChI=1S/C23H33Cl3O4/c1-2-3-4-5-6-7-8-9-12-17-29-20(27)13-10-11-14-21(28)30-23-19(25)16-15-18(24)22(23)26/h15-16H,2-14,17H2,1H3
- InChI Key
- HQOXCIGJBBNQFS-UHFFFAOYSA-N
- Formula
- C23H33Cl3O4
- SMILES
-
CCCCCCCCCCCOC(=O)CCCCC(=O)Oc1c
(Cl)ccc(Cl)c1Cl - Molecular Weight1
- 479.87
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.1800 | Relay (... Calculated Property | |
| ΔfG° | -277.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -962.98 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 66.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 127.43 | kJ/mol | Relay (... Calculated Property |
| IE | 8.64 | eV | Relay (... Calculated Property |
| log10WS | -7.81 | Relay (... Calculated Property | |
| logPoct/wat | 8.187 | Crippen Calculated Property | |
| McVol | 362.770 | ml/mol | McGowan Calculated Property |
| Pc | 1002.08 | kPa | Joback Calculated Property |
| Inp | 3269.00 | NIST | |
| Tboil | 671.16 | K | Relay (... Calculated Property |
| Tc | 916.81 | K | Relay (... Calculated Property |
| Tfus | 324.30 | K | Relay (... Calculated Property |
| Vc | 1.352 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1130.08; 1186.45] | J/mol×K | [1032.13; 1263.80] | 
|
| Cp,gas | 1130.08 | J/mol×K | 1032.13 | Joback Calculated Property |
| Cp,gas | 1143.05 | J/mol×K | 1070.74 | Joback Calculated Property |
| Cp,gas | 1154.54 | J/mol×K | 1109.35 | Joback Calculated Property |
| Cp,gas | 1164.59 | J/mol×K | 1147.97 | Joback Calculated Property |
| Cp,gas | 1173.23 | J/mol×K | 1186.58 | Joback Calculated Property |
| Cp,gas | 1180.50 | J/mol×K | 1225.19 | Joback Calculated Property |
| Cp,gas | 1186.45 | J/mol×K | 1263.80 | Joback Calculated Property |
| η | [0.0000223; 0.0001787] | Pa×s | [647.03; 1032.13] |
|
| η | 0.0001787 | Pa×s | 647.03 | Joback Calculated Property |
| η | 0.0001081 | Pa×s | 711.21 | Joback Calculated Property |
| η | 0.0000710 | Pa×s | 775.40 | Joback Calculated Property |
| η | 0.0000498 | Pa×s | 839.58 | Joback Calculated Property |
| η | 0.0000367 | Pa×s | 903.76 | Joback Calculated Property |
| η | 0.0000282 | Pa×s | 967.95 | Joback Calculated Property |
| η | 0.0000223 | Pa×s | 1032.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, 2,3,6-trichlorophenyl undecyl ester.
Sources
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