- InChI
- InChI=1S/C15H13Cl5O4/c1-2-3-4-7-23-8(21)5-6-9(22)24-15-13(19)11(17)10(16)12(18)14(15)20/h5-6H,2-4,7H2,1H3/b6-5+
- InChI Key
- VLYJINNDRWZADO-AATRIKPKSA-N
- Formula
- C15H13Cl5O4
- SMILES
-
CCCCCOC(=O)C=CC(=O)Oc1c(Cl)c(C
l)c(Cl)c(Cl)c1Cl - Molecular Weight1
- 434.53
- 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° | -307.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -624.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.77 | kJ/mol | Joback Calculated Property |
| log10WS | -6.86 | Crippen Calculated Property | |
| logPoct/wat | 6.149 | Crippen Calculated Property | |
| McVol | 270.230 | ml/mol | McGowan Calculated Property |
| Pc | 1675.53 | kPa | Joback Calculated Property |
| Inp | [2804.00; 2804.00] |
|
|
| Inp | 2804.00 | NIST | |
| Inp | 2804.00 | NIST | |
| Tboil | 938.07 | K | Joback Calculated Property |
| Tc | 1168.76 | K | Joback Calculated Property |
| Tfus | 636.67 | K | Joback Calculated Property |
| Vc | 1.040 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [672.05; 709.17] | J/mol×K | [938.07; 1168.76] |
|
| Cp,gas | 672.05 | J/mol×K | 938.07 | Joback Calculated Property |
| Cp,gas | 680.55 | J/mol×K | 976.52 | Joback Calculated Property |
| Cp,gas | 688.11 | J/mol×K | 1014.97 | Joback Calculated Property |
| Cp,gas | 694.73 | J/mol×K | 1053.41 | Joback Calculated Property |
| Cp,gas | 700.45 | J/mol×K | 1091.86 | Joback Calculated Property |
| Cp,gas | 705.25 | J/mol×K | 1130.31 | Joback Calculated Property |
| Cp,gas | 709.17 | J/mol×K | 1168.76 | Joback Calculated Property |
| η | [0.0000489; 0.0002304] | Pa×s | [636.67; 938.07] |
|
| η | 0.0002304 | Pa×s | 636.67 | Joback Calculated Property |
| η | 0.0001619 | Pa×s | 686.90 | Joback Calculated Property |
| η | 0.0001194 | Pa×s | 737.14 | Joback Calculated Property |
| η | 0.0000916 | Pa×s | 787.37 | Joback Calculated Property |
| η | 0.0000725 | Pa×s | 837.60 | Joback Calculated Property |
| η | 0.0000589 | Pa×s | 887.84 | Joback Calculated Property |
| η | 0.0000489 | Pa×s | 938.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, pentachlorophenyl pentyl ester.
Sources
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