- InChI
- InChI=1S/C20H34Cl2O4/c21-15-9-5-1-3-7-11-17-25-19(23)13-14-20(24)26-18-12-8-4-2-6-10-16-22/h13-14H,1-12,15-18H2/b14-13+
- InChI Key
- QMQZGFHUZRFAIY-BUHFOSPRSA-N
- Formula
- C20H34Cl2O4
- SMILES
-
O=C(C=CC(=O)OCCCCCCCCCl)OCCCCC
CCCCl - Molecular Weight1
- 409.39
- 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° | -293.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -859.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.15 | kJ/mol | Joback Calculated Property |
| log10WS | -6.08 | Crippen Calculated Property | |
| logPoct/wat | 5.788 | Crippen Calculated Property | |
| McVol | 327.720 | ml/mol | McGowan Calculated Property |
| Pc | 1062.40 | kPa | Joback Calculated Property |
| Inp | [3080.00; 3080.00] |
|
|
| Inp | 3080.00 | NIST | |
| Inp | 3080.00 | NIST | |
| Tboil | 888.60 | K | Joback Calculated Property |
| Tc | 1088.64 | K | Joback Calculated Property |
| Tfus | 514.24 | K | Joback Calculated Property |
| Vc | 1.282 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1003.09; 1083.39] | J/mol×K | [888.60; 1088.64] |
|
| Cp,gas | 1003.09 | J/mol×K | 888.60 | Joback Calculated Property |
| Cp,gas | 1018.99 | J/mol×K | 921.94 | Joback Calculated Property |
| Cp,gas | 1033.83 | J/mol×K | 955.28 | Joback Calculated Property |
| Cp,gas | 1047.65 | J/mol×K | 988.62 | Joback Calculated Property |
| Cp,gas | 1060.50 | J/mol×K | 1021.96 | Joback Calculated Property |
| Cp,gas | 1072.40 | J/mol×K | 1055.30 | Joback Calculated Property |
| Cp,gas | 1083.39 | J/mol×K | 1088.64 | Joback Calculated Property |
| η | [0.0000337; 0.0004822] | Pa×s | [514.24; 888.60] |
|
| η | 0.0004822 | Pa×s | 514.24 | Joback Calculated Property |
| η | 0.0002434 | Pa×s | 576.63 | Joback Calculated Property |
| η | 0.0001404 | Pa×s | 639.03 | Joback Calculated Property |
| η | 0.0000893 | Pa×s | 701.42 | Joback Calculated Property |
| η | 0.0000612 | Pa×s | 763.81 | Joback Calculated Property |
| η | 0.0000444 | Pa×s | 826.21 | Joback Calculated Property |
| η | 0.0000337 | Pa×s | 888.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, di(8-chlorooctyl) ester.
Sources
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