- InChI
- InChI=1S/C18H22Cl2O4/c1-3-5-6-13(4-2)12-23-17(21)9-10-18(22)24-16-8-7-14(19)11-15(16)20/h7-11,13H,3-6,12H2,1-2H3/b10-9+
- InChI Key
- WLWUHSKOPQSOKH-MDZDMXLPSA-N
- Formula
- C18H22Cl2O4
- SMILES
-
CCCCC(CC)COC(=O)C=CC(=O)Oc1ccc
(Cl)cc1Cl - Molecular Weight1
- 373.27
- 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° | -220.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -610.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.91 | kJ/mol | Joback Calculated Property |
| log10WS | -5.82 | Crippen Calculated Property | |
| logPoct/wat | 5.215 | Crippen Calculated Property | |
| McVol | 275.780 | ml/mol | McGowan Calculated Property |
| Pc | 1517.57 | kPa | Joback Calculated Property |
| Inp | [2509.00; 2509.00] |
|
|
| Inp | 2509.00 | NIST | |
| Inp | 2509.00 | NIST | |
| Tboil | 879.04 | K | Joback Calculated Property |
| Tc | 1095.34 | K | Joback Calculated Property |
| Tfus | 528.16 | K | Joback Calculated Property |
| Vc | 1.056 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [785.49; 848.20] | J/mol×K | [879.04; 1095.34] |
|
| Cp,gas | 785.49 | J/mol×K | 879.04 | Joback Calculated Property |
| Cp,gas | 798.45 | J/mol×K | 915.09 | Joback Calculated Property |
| Cp,gas | 810.36 | J/mol×K | 951.14 | Joback Calculated Property |
| Cp,gas | 821.26 | J/mol×K | 987.19 | Joback Calculated Property |
| Cp,gas | 831.18 | J/mol×K | 1023.24 | Joback Calculated Property |
| Cp,gas | 840.15 | J/mol×K | 1059.29 | Joback Calculated Property |
| Cp,gas | 848.20 | J/mol×K | 1095.34 | Joback Calculated Property |
| η | [0.0000439; 0.0004334] | Pa×s | [528.16; 879.04] |
|
| η | 0.0004334 | Pa×s | 528.16 | Joback Calculated Property |
| η | 0.0002447 | Pa×s | 586.64 | Joback Calculated Property |
| η | 0.0001532 | Pa×s | 645.12 | Joback Calculated Property |
| η | 0.0001037 | Pa×s | 703.60 | Joback Calculated Property |
| η | 0.0000745 | Pa×s | 762.08 | Joback Calculated Property |
| η | 0.0000561 | Pa×s | 820.56 | Joback Calculated Property |
| η | 0.0000439 | Pa×s | 879.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2,4-dichlorophenyl 2-ethylhexyl ester.
Sources
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