- InChI
- InChI=1S/C4H8F3N/c1-8(2)3-4(5,6)7/h3H2,1-2H3
- InChI Key
- PVSHBYHMVOHXIM-UHFFFAOYSA-N
- Formula
- C4H8F3N
- SMILES
- CN(C)CC(F)(F)F
- Molecular Weight1
- 127.11
- CAS
- 819-06-7
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- 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 |
|---|---|---|---|
| PAff | 902.70 | kJ/mol | NIST |
| BasG | 871.90 | kJ/mol | NIST |
| ΔfG° | -488.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -655.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 10.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 22.79 | kJ/mol | Joback Calculated Property |
| IE | [8.20; 8.42] | eV |
|
| IE | 8.42 ± 0.03 | eV | NIST |
| IE | 8.20 | eV | NIST |
| log10WS | -0.73 | Crippen Calculated Property | |
| logPoct/wat | 1.110 | Crippen Calculated Property | |
| McVol | 82.510 | ml/mol | McGowan Calculated Property |
| Pc | 3380.21 | kPa | Joback Calculated Property |
| Tboil | 297.94 | K | Joback Calculated Property |
| Tc | 442.35 | K | Joback Calculated Property |
| Tfus | 171.50 | K | Joback Calculated Property |
| Vc | 0.321 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [139.15; 189.13] | J/mol×K | [297.94; 442.35] |
|
| Cp,gas | 139.15 | J/mol×K | 297.94 | Joback Calculated Property |
| Cp,gas | 148.50 | J/mol×K | 322.01 | Joback Calculated Property |
| Cp,gas | 157.43 | J/mol×K | 346.08 | Joback Calculated Property |
| Cp,gas | 165.95 | J/mol×K | 370.14 | Joback Calculated Property |
| Cp,gas | 174.06 | J/mol×K | 394.21 | Joback Calculated Property |
| Cp,gas | 181.78 | J/mol×K | 418.28 | Joback Calculated Property |
| Cp,gas | 189.13 | J/mol×K | 442.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethyl(2,2-difluoroethyl)amine.
Sources
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