- InChI
- InChI=1S/C17H16F3NO/c1-3-21(13-8-6-7-12(2)11-13)16(22)14-9-4-5-10-15(14)17(18,19)20/h4-11H,3H2,1-2H3
- InChI Key
- GKQHPZYDVPDQKH-UHFFFAOYSA-N
- Formula
- C17H16F3NO
- SMILES
-
CCN(C(=O)c1ccccc1C(F)(F)F)c1cc
cc(C)c1 - Molecular Weight1
- 307.31
- 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° | -301.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -586.22 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.35 | kJ/mol | Joback Calculated Property |
| log10WS | -5.34 | Crippen Calculated Property | |
| logPoct/wat | 4.681 | Crippen Calculated Property | |
| McVol | 219.730 | ml/mol | McGowan Calculated Property |
| Pc | 1935.54 | kPa | Joback Calculated Property |
| Inp | 1829.00 | NIST | |
| Tboil | 712.57 | K | Joback Calculated Property |
| Tc | 926.12 | K | Joback Calculated Property |
| Tfus | 445.82 | K | Joback Calculated Property |
| Vc | 0.839 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [609.14; 684.03] | J/mol×K | [712.57; 926.12] | 
|
| Cp,gas | 609.14 | J/mol×K | 712.57 | Joback Calculated Property |
| Cp,gas | 624.19 | J/mol×K | 748.16 | Joback Calculated Property |
| Cp,gas | 638.10 | J/mol×K | 783.75 | Joback Calculated Property |
| Cp,gas | 650.96 | J/mol×K | 819.35 | Joback Calculated Property |
| Cp,gas | 662.84 | J/mol×K | 854.94 | Joback Calculated Property |
| Cp,gas | 673.84 | J/mol×K | 890.53 | Joback Calculated Property |
| Cp,gas | 684.03 | J/mol×K | 926.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-ethyl-N-(3-methylphenyl)-2-trifluoromethyl-.
Sources
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