- InChI
- InChI=1S/C12H10Cl2O4/c1-2-17-11(15)3-4-12(16)18-10-6-8(13)5-9(14)7-10/h3-7H,2H2,1H3/b4-3+
- InChI Key
- NTLLZAXEGZZMPE-ONEGZZNKSA-N
- Formula
- C12H10Cl2O4
- SMILES
-
CCOC(=O)C=CC(=O)Oc1cc(Cl)cc(Cl
)c1 - Molecular Weight1
- 289.11
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.7006 | Relay (1.0) Calculated Property | |
| ΔfG° | -268.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -641.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.07 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.19 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.99 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.018 | Crippen Calculated Property | |
| McVol | 191.240 | ml/mol | McGowan Calculated Property |
| Pc | 2502.50 | kPa | Joback Calculated Property |
| Inp | [1999.00; 1999.00] |
|
|
| Inp | 1999.00 | NIST | |
| Inp | 1999.00 | NIST | |
| Tboil | 578.68 | K | Relay (1.0) Calculated Property |
| Tc | 798.68 | K | Relay (1.0) Calculated Property |
| Tfus | 329.03 | K | Relay (1.0) Calculated Property |
| Vc | 0.673 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [458.46; 509.93] | J/mol×K | [742.20; 969.04] |
|
| Cp,gas | 458.46 | J/mol×K | 742.20 | Joback Calculated Property |
| Cp,gas | 469.03 | J/mol×K | 780.01 | Joback Calculated Property |
| Cp,gas | 478.79 | J/mol×K | 817.81 | Joback Calculated Property |
| Cp,gas | 487.74 | J/mol×K | 855.62 | Joback Calculated Property |
| Cp,gas | 495.91 | J/mol×K | 893.43 | Joback Calculated Property |
| Cp,gas | 503.30 | J/mol×K | 931.24 | Joback Calculated Property |
| Cp,gas | 509.93 | J/mol×K | 969.04 | Joback Calculated Property |
| η | [0.0001075; 0.0006727] | Pa×s | [475.54; 742.20] |
|
| η | 0.0006727 | Pa×s | 475.54 | Joback Calculated Property |
| η | 0.0004349 | Pa×s | 519.98 | Joback Calculated Property |
| η | 0.0003012 | Pa×s | 564.43 | Joback Calculated Property |
| η | 0.0002201 | Pa×s | 608.87 | Joback Calculated Property |
| η | 0.0001678 | Pa×s | 653.31 | Joback Calculated Property |
| η | 0.0001324 | Pa×s | 697.76 | Joback Calculated Property |
| η | 0.0001075 | Pa×s | 742.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 3,5-dichlorophenyl ethyl ester.
Sources
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