- InChI
- InChI=1S/C2F3N/c1-6-2(3,4)5
- InChI Key
- LKHQVUSYAMWNQZ-UHFFFAOYSA-N
- Formula
- C2F3N
- SMILES
- [C-]#[N+]C(F)(F)F
- Molecular Weight1
- 95.02
- CAS
- 105879-13-8
- 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).
- 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).
- 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° | -482.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -417.00 ± 29.00 | kJ/mol | NIST |
| ΔfusH° | 4.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 26.78 | kJ/mol | Joback Calculated Property |
| log10WS | -3.58 | Crippen Calculated Property | |
| logPoct/wat | 1.425 | Crippen Calculated Property | |
| McVol | 45.730 | ml/mol | McGowan Calculated Property |
| Pc | 4156.97 | kPa | Joback Calculated Property |
| Tboil | 341.82 | K | Joback Calculated Property |
| Tc | 516.00 | K | Joback Calculated Property |
| Tfus | 181.48 | K | Joback Calculated Property |
| Vc | 0.216 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [82.59; 101.24] | J/mol×K | [341.82; 516.00] | 
|
| Cp,gas | 82.59 | J/mol×K | 341.82 | Joback Calculated Property |
| Cp,gas | 86.37 | J/mol×K | 370.85 | Joback Calculated Property |
| Cp,gas | 89.86 | J/mol×K | 399.88 | Joback Calculated Property |
| Cp,gas | 93.07 | J/mol×K | 428.91 | Joback Calculated Property |
| Cp,gas | 96.03 | J/mol×K | 457.94 | Joback Calculated Property |
| Cp,gas | 98.75 | J/mol×K | 486.97 | Joback Calculated Property |
| Cp,gas | 101.24 | J/mol×K | 516.00 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Trifluoromethylisocyanide.
Sources
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