- InChI
- InChI=1S/C8H4Cl4O2/c9-5-2-1-4(3-6(5)10)14-8(13)7(11)12/h1-3,7H
- InChI Key
- VEVXIXJKVRAVCE-UHFFFAOYSA-N
- Formula
- C8H4Cl4O2
- SMILES
- O=C(Oc1ccc(Cl)c(Cl)c1)C(Cl)Cl
- Molecular Weight1
- 273.93
- 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 | 0.5469 | Relay (1.0) Calculated Property | |
| ΔfG° | -174.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -361.97 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.87 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.20 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.38 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.702 | Crippen Calculated Property | |
| McVol | 156.220 | ml/mol | McGowan Calculated Property |
| Pc | 3159.72 | kPa | Joback Calculated Property |
| Inp | 1650.00 | NIST | |
| Tboil | 556.08 | K | Relay (1.0) Calculated Property |
| Tc | 825.67 | K | Relay (1.0) Calculated Property |
| Tfus | 328.74 | K | Relay (1.0) Calculated Property |
| Vc | 0.546 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [299.25; 338.09] | J/mol×K | [644.65; 888.29] | 
|
| Cp,gas | 299.25 | J/mol×K | 644.65 | Joback Calculated Property |
| Cp,gas | 307.32 | J/mol×K | 685.26 | Joback Calculated Property |
| Cp,gas | 314.74 | J/mol×K | 725.86 | Joback Calculated Property |
| Cp,gas | 321.51 | J/mol×K | 766.47 | Joback Calculated Property |
| Cp,gas | 327.65 | J/mol×K | 807.07 | Joback Calculated Property |
| Cp,gas | 333.18 | J/mol×K | 847.68 | Joback Calculated Property |
| Cp,gas | 338.09 | J/mol×K | 888.29 | Joback Calculated Property |
| η | [0.0001978; 0.0012887] | Pa×s | [408.22; 644.65] |
|
| η | 0.0012887 | Pa×s | 408.22 | Joback Calculated Property |
| η | 0.0008218 | Pa×s | 447.62 | Joback Calculated Property |
| η | 0.0005637 | Pa×s | 487.03 | Joback Calculated Property |
| η | 0.0004091 | Pa×s | 526.43 | Joback Calculated Property |
| η | 0.0003104 | Pa×s | 565.84 | Joback Calculated Property |
| η | 0.0002442 | Pa×s | 605.25 | Joback Calculated Property |
| η | 0.0001978 | Pa×s | 644.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dichloroacetic acid, 3,4-dichlorophenyl ester.
Sources
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