- InChI
- InChI=1S/C20H37ClO4/c1-2-3-4-12-17-24-19(22)14-9-10-15-20(23)25-18-13-8-6-5-7-11-16-21/h2-18H2,1H3
- InChI Key
- QOKXDWWCPGIUMU-UHFFFAOYSA-N
- Formula
- C20H37ClO4
- SMILES
-
CCCCCCOC(=O)CCCCC(=O)OCCCCCCCC
Cl - Molecular Weight1
- 376.96
- 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 | 1.0872 | Relay (1.0) Calculated Property | |
| ΔfG° | -362.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1100.87 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 57.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.09 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.77 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.50 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.793 | Crippen Calculated Property | |
| McVol | 319.780 | ml/mol | McGowan Calculated Property |
| Pc | 1052.09 | kPa | Joback Calculated Property |
| Inp | [2651.00; 2651.00] |
|
|
| Inp | 2651.00 | NIST | |
| Inp | 2651.00 | NIST | |
| Tboil | 626.01 | K | Relay (1.0) Calculated Property |
| Tc | 810.22 | K | Relay (1.0) Calculated Property |
| Tfus | 288.37 | K | Relay (1.0) Calculated Property |
| Vc | 1.223 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1000.82; 1088.99] | J/mol×K | [847.01; 1037.90] |
|
| Cp,gas | 1000.82 | J/mol×K | 847.01 | Joback Calculated Property |
| Cp,gas | 1018.18 | J/mol×K | 878.83 | Joback Calculated Property |
| Cp,gas | 1034.44 | J/mol×K | 910.64 | Joback Calculated Property |
| Cp,gas | 1049.64 | J/mol×K | 942.46 | Joback Calculated Property |
| Cp,gas | 1063.78 | J/mol×K | 974.27 | Joback Calculated Property |
| Cp,gas | 1076.89 | J/mol×K | 1006.09 | Joback Calculated Property |
| Cp,gas | 1088.99 | J/mol×K | 1037.90 | Joback Calculated Property |
| η | [0.0000456; 0.0006619] | Pa×s | [489.40; 847.01] |
|
| η | 0.0006619 | Pa×s | 489.40 | Joback Calculated Property |
| η | 0.0003326 | Pa×s | 549.00 | Joback Calculated Property |
| η | 0.0001913 | Pa×s | 608.60 | Joback Calculated Property |
| η | 0.0001214 | Pa×s | 668.20 | Joback Calculated Property |
| η | 0.0000830 | Pa×s | 727.81 | Joback Calculated Property |
| η | 0.0000601 | Pa×s | 787.41 | Joback Calculated Property |
| η | 0.0000456 | Pa×s | 847.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, 8-chloroctyl hexyl ester.
Sources
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