- InChI
- InChI=1S/C8H7F2NO/c1-11-8(12)5-2-3-6(9)7(10)4-5/h2-4H,1H3,(H,11,12)
- InChI Key
- HQBRGWPNIBPNHR-UHFFFAOYSA-N
- Formula
- C8H7F2NO
- SMILES
- CNC(=O)c1ccc(F)c(F)c1
- Molecular Weight1
- 171.14
- 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).
- Inp : Non-polar retention indices.
- 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° | -319.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -446.19 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.55 | kJ/mol | Joback Calculated Property |
| log10WS | -2.48 | Crippen Calculated Property | |
| logPoct/wat | 1.324 | Crippen Calculated Property | |
| McVol | 114.910 | ml/mol | McGowan Calculated Property |
| Pc | 3464.28 | kPa | Joback Calculated Property |
| Inp | [1419.00; 1419.00] |
|
|
| Inp | 1419.00 | NIST | |
| Inp | 1419.00 | NIST | |
| Tboil | 521.66 | K | Joback Calculated Property |
| Tc | 724.57 | K | Joback Calculated Property |
| Tfus | 335.15 | K | Joback Calculated Property |
| Vc | 0.453 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [250.57; 303.35] | J/mol×K | [521.66; 724.57] |
|
| Cp,gas | 250.57 | J/mol×K | 521.66 | Joback Calculated Property |
| Cp,gas | 260.74 | J/mol×K | 555.48 | Joback Calculated Property |
| Cp,gas | 270.34 | J/mol×K | 589.30 | Joback Calculated Property |
| Cp,gas | 279.38 | J/mol×K | 623.11 | Joback Calculated Property |
| Cp,gas | 287.89 | J/mol×K | 656.93 | Joback Calculated Property |
| Cp,gas | 295.87 | J/mol×K | 690.75 | Joback Calculated Property |
| Cp,gas | 303.35 | J/mol×K | 724.57 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 3,4-difluoro-N-methyl-.
Sources
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