- InChI
- InChI=1S/C3F3N/c4-2(1-7)3(5)6
- InChI Key
- KDUAIKFAYXQCMF-UHFFFAOYSA-N
- Formula
- C3F3N
- SMILES
- N#CC(F)=C(F)F
- Molecular Weight1
- 107.03
- CAS
- 433-43-2
- Other Names
-
- Acrylonitrile, trifluoro-
- Perfluoroacrylonitrile
- CF2=CFCN
- 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).
- 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° | -413.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -431.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 30.42 | kJ/mol | Joback Calculated Property |
| IE | 10.60 ± 0.10 | eV | NIST |
| log10WS | -1.84 | Crippen Calculated Property | |
| logPoct/wat | 1.588 | Crippen Calculated Property | |
| McVol | 55.520 | ml/mol | McGowan Calculated Property |
| Pc | 3886.79 | kPa | Joback Calculated Property |
| Tboil | 371.85 | K | Joback Calculated Property |
| Tc | 550.66 | K | Joback Calculated Property |
| Tfus | 157.33 | K | Joback Calculated Property |
| Vc | 0.266 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [95.95; 115.16] | J/mol×K | [371.85; 550.66] | 
|
| Cp,gas | 95.95 | J/mol×K | 371.85 | Joback Calculated Property |
| Cp,gas | 99.74 | J/mol×K | 401.65 | Joback Calculated Property |
| Cp,gas | 103.27 | J/mol×K | 431.45 | Joback Calculated Property |
| Cp,gas | 106.57 | J/mol×K | 461.26 | Joback Calculated Property |
| Cp,gas | 109.64 | J/mol×K | 491.06 | Joback Calculated Property |
| Cp,gas | 112.50 | J/mol×K | 520.86 | Joback Calculated Property |
| Cp,gas | 115.16 | J/mol×K | 550.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Propenenitrile, 2,3,3-trifluoro-.
Sources
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