- InChI
- InChI=1S/C14H11Cl5O4/c1-2-3-6-22-7(20)4-5-8(21)23-14-12(18)10(16)9(15)11(17)13(14)19/h4-5H,2-3,6H2,1H3/b5-4+
- InChI Key
- FWAPVTJQGLXHOP-SNAWJCMRSA-N
- Formula
- C14H11Cl5O4
- SMILES
-
CCCCOC(=O)C=CC(=O)Oc1c(Cl)c(Cl
)c(Cl)c(Cl)c1Cl - Molecular Weight1
- 420.50
- 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° | -316.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -604.19 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.54 | kJ/mol | Joback Calculated Property |
| log10WS | -6.44 | Crippen Calculated Property | |
| logPoct/wat | 5.758 | Crippen Calculated Property | |
| McVol | 256.140 | ml/mol | McGowan Calculated Property |
| Pc | 1815.41 | kPa | Joback Calculated Property |
| Inp | [2699.00; 2699.00] |
|
|
| Inp | 2699.00 | NIST | |
| Inp | 2699.00 | NIST | |
| Tboil | 915.19 | K | Joback Calculated Property |
| Tc | 1147.20 | K | Joback Calculated Property |
| Tfus | 625.40 | K | Joback Calculated Property |
| Vc | 0.985 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [616.95; 652.63] | J/mol×K | [915.19; 1147.20] |
|
| Cp,gas | 616.95 | J/mol×K | 915.19 | Joback Calculated Property |
| Cp,gas | 625.11 | J/mol×K | 953.86 | Joback Calculated Property |
| Cp,gas | 632.38 | J/mol×K | 992.53 | Joback Calculated Property |
| Cp,gas | 638.76 | J/mol×K | 1031.19 | Joback Calculated Property |
| Cp,gas | 644.26 | J/mol×K | 1069.86 | Joback Calculated Property |
| Cp,gas | 648.88 | J/mol×K | 1108.53 | Joback Calculated Property |
| Cp,gas | 652.63 | J/mol×K | 1147.20 | Joback Calculated Property |
| η | [0.0000566; 0.0002552] | Pa×s | [625.40; 915.19] |
|
| η | 0.0002552 | Pa×s | 625.40 | Joback Calculated Property |
| η | 0.0001815 | Pa×s | 673.70 | Joback Calculated Property |
| η | 0.0001351 | Pa×s | 722.00 | Joback Calculated Property |
| η | 0.0001043 | Pa×s | 770.30 | Joback Calculated Property |
| η | 0.0000831 | Pa×s | 818.59 | Joback Calculated Property |
| η | 0.0000678 | Pa×s | 866.89 | Joback Calculated Property |
| η | 0.0000566 | Pa×s | 915.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, butyl pentachlorophenyl ester.
Sources
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