- InChI
- InChI=1S/C2H3ClF3N/c1-2(4,5)7(3)6/h1H3
- InChI Key
- ITYSTFRAOPTVON-UHFFFAOYSA-N
- Formula
- C2H3ClF3N
- SMILES
- CC(F)(F)N(F)Cl
- Molecular Weight1
- 133.50
- Other Names
-
- Ethylamine, N-chloro-N,1,1-trifluoro-
- N-chloro-N,1,1-trifluoroethanamine
- ω : Acentric Factor.
- 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).
- 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 | 0.2488 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -391.88 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 9.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 27.61 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.11 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 1.939 | Crippen Calculated Property | |
| McVol | 66.570 | ml/mol | McGowan Calculated Property |
| Pc | 4082.92 | kPa | Joback Calculated Property |
| Tboil | 292.53 | K | Relay (1.0) Calculated Property |
| Tc | 458.72 | K | Relay (1.0) Calculated Property |
| Tfus | 169.46 | K | Relay (1.0) Calculated Property |
| Vc | 0.286 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Standard Gibbs free energy of formation, 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 | [104.56; 138.71] | J/mol×K | [289.81; 441.78] | 
|
| Cp,gas | 104.56 | J/mol×K | 289.81 | Joback Calculated Property |
| Cp,gas | 111.16 | J/mol×K | 315.14 | Joback Calculated Property |
| Cp,gas | 117.38 | J/mol×K | 340.47 | Joback Calculated Property |
| Cp,gas | 123.23 | J/mol×K | 365.80 | Joback Calculated Property |
| Cp,gas | 128.73 | J/mol×K | 391.12 | Joback Calculated Property |
| Cp,gas | 133.88 | J/mol×K | 416.45 | Joback Calculated Property |
| Cp,gas | 138.71 | J/mol×K | 441.78 | Joback Calculated Property |
| ΔvapH | 30.80 | kJ/mol | 257.00 | NIST |
Similar Compounds
Find more compounds similar to Ethanamine, N-chloro-N,1,1-trifluoro-.
Sources
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