- InChI
- InChI=1S/C11H12F3NO/c1-3-15(2)10(16)8-5-4-6-9(7-8)11(12,13)14/h4-7H,3H2,1-2H3
- InChI Key
- HCYJYRBBNVVAMZ-UHFFFAOYSA-N
- Formula
- C11H12F3NO
- SMILES
- CCN(C)C(=O)c1cccc(C(F)(F)F)c1
- Molecular Weight1
- 231.21
- 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° | -455.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -687.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.06 | kJ/mol | Joback Calculated Property |
| log10WS | -3.14 | Crippen Calculated Property | |
| logPoct/wat | 2.797 | Crippen Calculated Property | |
| McVol | 158.950 | ml/mol | McGowan Calculated Property |
| Pc | 2467.81 | kPa | Joback Calculated Property |
| Inp | [1588.00; 1588.00] |
|
|
| Inp | 1588.00 | NIST | |
| Inp | 1588.00 | NIST | |
| Tboil | 543.63 | K | Joback Calculated Property |
| Tc | 735.72 | K | Joback Calculated Property |
| Tfus | 339.26 | K | Joback Calculated Property |
| Vc | 0.611 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [384.31; 455.19] | J/mol×K | [543.63; 735.72] |
|
| Cp,gas | 384.31 | J/mol×K | 543.63 | Joback Calculated Property |
| Cp,gas | 398.24 | J/mol×K | 575.64 | Joback Calculated Property |
| Cp,gas | 411.26 | J/mol×K | 607.66 | Joback Calculated Property |
| Cp,gas | 423.42 | J/mol×K | 639.67 | Joback Calculated Property |
| Cp,gas | 434.76 | J/mol×K | 671.69 | Joback Calculated Property |
| Cp,gas | 445.34 | J/mol×K | 703.70 | Joback Calculated Property |
| Cp,gas | 455.19 | J/mol×K | 735.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 3-trifluoromethyl-N-ethyl-N-methyl-.
Sources
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