- InChI
- InChI=1S/C8H3Cl5O2/c9-5-2-1-4(3-6(5)10)15-7(14)8(11,12)13/h1-3H
- InChI Key
- HDGSKVNDSCZMPE-UHFFFAOYSA-N
- Formula
- C8H3Cl5O2
- SMILES
-
O=C(Oc1ccc(Cl)c(Cl)c1)C(Cl)(Cl
)Cl - Molecular Weight1
- 308.37
- 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° | -181.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -327.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.79 | kJ/mol | Joback Calculated Property |
| log10WS | -4.72 | Crippen Calculated Property | |
| logPoct/wat | 4.269 | Crippen Calculated Property | |
| McVol | 168.460 | ml/mol | McGowan Calculated Property |
| Pc | 3069.34 | kPa | Joback Calculated Property |
| Inp | [1724.00; 1724.00] |
|
|
| Inp | 1724.00 | NIST | |
| Inp | 1724.00 | NIST | |
| Tboil | 679.29 | K | Joback Calculated Property |
| Tc | 935.40 | K | Joback Calculated Property |
| Tfus | 455.56 | K | Joback Calculated Property |
| Vc | 0.633 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [320.65; 352.92] | J/mol×K | [679.29; 935.40] |
|
| Cp,gas | 320.65 | J/mol×K | 679.29 | Joback Calculated Property |
| Cp,gas | 327.75 | J/mol×K | 721.97 | Joback Calculated Property |
| Cp,gas | 334.09 | J/mol×K | 764.66 | Joback Calculated Property |
| Cp,gas | 339.73 | J/mol×K | 807.34 | Joback Calculated Property |
| Cp,gas | 344.71 | J/mol×K | 850.03 | Joback Calculated Property |
| Cp,gas | 349.09 | J/mol×K | 892.71 | Joback Calculated Property |
| Cp,gas | 352.92 | J/mol×K | 935.40 | Joback Calculated Property |
| η | [0.0001636; 0.0009686] | Pa×s | [455.56; 679.29] |
|
| η | 0.0009686 | Pa×s | 455.56 | Joback Calculated Property |
| η | 0.0006437 | Pa×s | 492.85 | Joback Calculated Property |
| η | 0.0004531 | Pa×s | 530.14 | Joback Calculated Property |
| η | 0.0003340 | Pa×s | 567.42 | Joback Calculated Property |
| η | 0.0002557 | Pa×s | 604.71 | Joback Calculated Property |
| η | 0.0002019 | Pa×s | 642.00 | Joback Calculated Property |
| η | 0.0001636 | Pa×s | 679.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Trichloroacetic acid, 3,4-dichlorophenyl ester.
Sources
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