- InChI
- InChI=1S/C3H4ClF3O/c1-8-3(6,7)2(4)5/h2H,1H3
- InChI Key
- KKXBMWAROXAWSZ-UHFFFAOYSA-N
- Formula
- C3H4ClF3O
- SMILES
- COC(F)(F)C(F)Cl
- Molecular Weight1
- 148.51
- CAS
- 425-87-6
- Other Names
-
- Ether, 2-chloro-1,1,2-trifluoroethyl methyl
- 2-Chloro-1,1,2-trifluoroethyl methyl ether
- 1-Chloro-1,2,2-trifluoro-2-methoxyethane
- 2-chloro-1,1,2-trifluoro-1-methoxyethane
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -850.05 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 7.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [34.40; 34.53] | kJ/mol |
|
| ΔvapH° | 34.53 | kJ/mol | NIST |
| ΔvapH° | 34.40 ± 0.10 | kJ/mol | NIST |
| IE | 11.48 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 1.760 | Crippen Calculated Property | |
| McVol | 76.550 | ml/mol | McGowan Calculated Property |
| Pc | 3594.25 | kPa | Joback Calculated Property |
| Tboil | 343.40 | K | NIST |
| Tc | 508.20 | K | NIST |
| Tfus | 180.24 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [133.25; 167.21] | J/mol×K | [322.03; 481.50] |
|
| Cp,gas | 133.25 | J/mol×K | 322.03 | Joback Calculated Property |
| Cp,gas | 139.60 | J/mol×K | 348.61 | Joback Calculated Property |
| Cp,gas | 145.67 | J/mol×K | 375.19 | Joback Calculated Property |
| Cp,gas | 151.45 | J/mol×K | 401.76 | Joback Calculated Property |
| Cp,gas | 156.97 | J/mol×K | 428.34 | Joback Calculated Property |
| Cp,gas | 162.22 | J/mol×K | 454.92 | Joback Calculated Property |
| Cp,gas | 167.21 | J/mol×K | 481.50 | Joback Calculated Property |
| ΔvapH | [31.10; 33.40] | kJ/mol | [313.00; 343.40] |
|
| ΔvapH | 33.40 ± 0.10 | kJ/mol | 313.00 | NIST |
| ΔvapH | 31.10 ± 0.10 | kJ/mol | 343.00 | NIST |
| ΔvapH | 31.12 | kJ/mol | 343.40 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 337.50 | K | 84.00 | NIST |
Similar Compounds
Find more compounds similar to Ethane, 2-chloro-1,1,2-trifluoro-1-methoxy-.
Sources
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