- InChI
- InChI=1S/C15H20F3NO/c1-2-3-4-5-6-7-10-19-15(20)11-8-9-12(16)14(18)13(11)17/h8-9H,2-7,10H2,1H3,(H,19,20)
- InChI Key
- QHIUFQNFCDTOMV-UHFFFAOYSA-N
- Formula
- C15H20F3NO
- SMILES
- CCCCCCCCNC(=O)c1ccc(F)c(F)c1F
- Molecular Weight1
- 287.32
- 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° | -465.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -798.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.98 | kJ/mol | Joback Calculated Property |
| log10WS | -5.74 | Crippen Calculated Property | |
| logPoct/wat | 4.194 | Crippen Calculated Property | |
| McVol | 215.310 | ml/mol | McGowan Calculated Property |
| Pc | 1692.12 | kPa | Joback Calculated Property |
| Inp | [1929.00; 1929.00] |
|
|
| Inp | 1929.00 | NIST | |
| Inp | 1929.00 | NIST | |
| Tboil | 686.07 | K | Joback Calculated Property |
| Tc | 867.72 | K | Joback Calculated Property |
| Tfus | 427.15 | K | Joback Calculated Property |
| Vc | 0.863 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [597.60; 672.67] | J/mol×K | [686.07; 867.72] |
|
| Cp,gas | 597.60 | J/mol×K | 686.07 | Joback Calculated Property |
| Cp,gas | 611.91 | J/mol×K | 716.34 | Joback Calculated Property |
| Cp,gas | 625.46 | J/mol×K | 746.62 | Joback Calculated Property |
| Cp,gas | 638.30 | J/mol×K | 776.89 | Joback Calculated Property |
| Cp,gas | 650.43 | J/mol×K | 807.17 | Joback Calculated Property |
| Cp,gas | 661.88 | J/mol×K | 837.44 | Joback Calculated Property |
| Cp,gas | 672.67 | J/mol×K | 867.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 2,3,4-trifluoro-N-octyl-.
Sources
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