- InChI
- InChI=1S/C6H7Cl3O2/c1-4(2)5(10)11-3-6(7,8)9/h1,3H2,2H3
- InChI Key
- IUGNCEABJSRDPG-UHFFFAOYSA-N
- Formula
- C6H7Cl3O2
- SMILES
- C=C(C)C(=O)OCC(Cl)(Cl)Cl
- Molecular Weight1
- 217.48
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.4146 | Relay (1.0) Calculated Property | |
| ΔfG° | -187.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -403.19 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.49 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.61 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.89 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.476 | Crippen Calculated Property | |
| McVol | 135.260 | ml/mol | McGowan Calculated Property |
| Pc | 3110.57 | kPa | Joback Calculated Property |
| Inp | [1138.00; 1138.00] |
|
|
| Inp | 1138.00 | NIST | |
| Inp | 1138.00 | NIST | |
| Tboil | 473.72 | K | Relay (1.0) Calculated Property |
| Tc | 682.04 | K | Relay (1.0) Calculated Property |
| Tfus | 333.59 | K | Relay (1.0) Calculated Property |
| Vc | 0.476 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [257.51; 301.77] | J/mol×K | [518.59; 734.98] |
|
| Cp,gas | 257.51 | J/mol×K | 518.59 | Joback Calculated Property |
| Cp,gas | 266.35 | J/mol×K | 554.65 | Joback Calculated Property |
| Cp,gas | 274.56 | J/mol×K | 590.72 | Joback Calculated Property |
| Cp,gas | 282.17 | J/mol×K | 626.78 | Joback Calculated Property |
| Cp,gas | 289.22 | J/mol×K | 662.85 | Joback Calculated Property |
| Cp,gas | 295.75 | J/mol×K | 698.91 | Joback Calculated Property |
| Cp,gas | 301.77 | J/mol×K | 734.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Methacrylic acid, 2,2,2-trichloroethyl ester.
Sources
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