- InChI
- InChI=1S/C14H11F2NO/c1-9-4-2-5-10(8-9)17-14(18)13-11(15)6-3-7-12(13)16/h2-8H,1H3,(H,17,18)
- InChI Key
- GLJNSSJUIBRIQJ-UHFFFAOYSA-N
- Formula
- C14H11F2NO
- SMILES
- Cc1cccc(NC(=O)c2c(F)cccc2F)c1
- Molecular Weight1
- 247.24
- 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° | -166.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -344.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.84 | kJ/mol | Joback Calculated Property |
| log10WS | -4.59 | Crippen Calculated Property | |
| logPoct/wat | 3.526 | Crippen Calculated Property | |
| McVol | 175.690 | ml/mol | McGowan Calculated Property |
| Pc | 2605.74 | kPa | Joback Calculated Property |
| Inp | 1959.00 | NIST | |
| Tboil | 690.60 | K | Joback Calculated Property |
| Tc | 915.42 | K | Joback Calculated Property |
| Tfus | 441.71 | K | Joback Calculated Property |
| Vc | 0.680 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [453.98; 518.63] | J/mol×K | [690.60; 915.42] | 
|
| Cp,gas | 453.98 | J/mol×K | 690.60 | Joback Calculated Property |
| Cp,gas | 467.03 | J/mol×K | 728.07 | Joback Calculated Property |
| Cp,gas | 479.12 | J/mol×K | 765.54 | Joback Calculated Property |
| Cp,gas | 490.27 | J/mol×K | 803.01 | Joback Calculated Property |
| Cp,gas | 500.55 | J/mol×K | 840.48 | Joback Calculated Property |
| Cp,gas | 509.98 | J/mol×K | 877.95 | Joback Calculated Property |
| Cp,gas | 518.63 | J/mol×K | 915.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-(3-methylphenyl)-2,6-difluoro-.
Sources
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