- InChI
- InChI=1S/C19H25ClO5/c1-23-16-8-10-17(11-9-16)25-19(22)13-12-18(21)24-15-7-5-3-2-4-6-14-20/h8-13H,2-7,14-15H2,1H3/b13-12+
- InChI Key
- WXBNGDVCNJWEHF-OUKQBFOZSA-N
- Formula
- C19H25ClO5
- SMILES
-
COc1ccc(OC(=O)C=CC(=O)OCCCCCCC
CCl)cc1 - Molecular Weight1
- 368.85
- 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° | -292.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -730.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.89 | kJ/mol | Joback Calculated Property |
| log10WS | -4.96 | Crippen Calculated Property | |
| logPoct/wat | 4.279 | Crippen Calculated Property | |
| McVol | 283.500 | ml/mol | McGowan Calculated Property |
| Pc | 1439.16 | kPa | Joback Calculated Property |
| Inp | [2904.00; 2904.00] |
|
|
| Inp | 2904.00 | NIST | |
| Inp | 2904.00 | NIST | |
| Tboil | 882.37 | K | Joback Calculated Property |
| Tc | 1091.85 | K | Joback Calculated Property |
| Tfus | 534.22 | K | Joback Calculated Property |
| Vc | 1.087 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [847.19; 913.54] | J/mol×K | [882.37; 1091.85] |
|
| Cp,gas | 847.19 | J/mol×K | 882.37 | Joback Calculated Property |
| Cp,gas | 860.98 | J/mol×K | 917.28 | Joback Calculated Property |
| Cp,gas | 873.66 | J/mol×K | 952.20 | Joback Calculated Property |
| Cp,gas | 885.22 | J/mol×K | 987.11 | Joback Calculated Property |
| Cp,gas | 895.71 | J/mol×K | 1022.03 | Joback Calculated Property |
| Cp,gas | 905.14 | J/mol×K | 1056.94 | Joback Calculated Property |
| Cp,gas | 913.54 | J/mol×K | 1091.85 | Joback Calculated Property |
| η | [0.0000356; 0.0003483] | Pa×s | [534.22; 882.37] |
|
| η | 0.0003483 | Pa×s | 534.22 | Joback Calculated Property |
| η | 0.0001977 | Pa×s | 592.25 | Joback Calculated Property |
| η | 0.0001241 | Pa×s | 650.27 | Joback Calculated Property |
| η | 0.0000841 | Pa×s | 708.29 | Joback Calculated Property |
| η | 0.0000605 | Pa×s | 766.32 | Joback Calculated Property |
| η | 0.0000455 | Pa×s | 824.34 | Joback Calculated Property |
| η | 0.0000356 | Pa×s | 882.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 4-methoxyphenyl 8-chlorooctyl ester.
Sources
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