- InChI
- InChI=1S/C18H25F4NO/c1-2-3-4-5-6-7-8-9-12-23-17(24)14-10-11-15(16(19)13-14)18(20,21)22/h10-11,13H,2-9,12H2,1H3,(H,23,24)
- InChI Key
- KMNLXWKKNBRTAW-UHFFFAOYSA-N
- Formula
- C18H25F4NO
- SMILES
-
CCCCCCCCCCNC(=O)c1ccc(C(F)(F)F
)c(F)c1 - Molecular Weight1
- 347.39
- 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° | -622.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1053.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.88 | kJ/mol | Joback Calculated Property |
| log10WS | -7.02 | Crippen Calculated Property | |
| logPoct/wat | 5.715 | Crippen Calculated Property | |
| McVol | 259.350 | ml/mol | McGowan Calculated Property |
| Pc | 1341.76 | kPa | Joback Calculated Property |
| Inp | [2197.00; 2197.00] |
|
|
| Inp | 2197.00 | NIST | |
| Inp | 2197.00 | NIST | |
| Tboil | 745.77 | K | Joback Calculated Property |
| Tc | 927.32 | K | Joback Calculated Property |
| Tfus | 451.45 | K | Joback Calculated Property |
| Vc | 1.038 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [773.78; 854.03] | J/mol×K | [745.77; 927.32] |
|
| Cp,gas | 773.78 | J/mol×K | 745.77 | Joback Calculated Property |
| Cp,gas | 789.20 | J/mol×K | 776.03 | Joback Calculated Property |
| Cp,gas | 803.75 | J/mol×K | 806.29 | Joback Calculated Property |
| Cp,gas | 817.45 | J/mol×K | 836.55 | Joback Calculated Property |
| Cp,gas | 830.37 | J/mol×K | 866.81 | Joback Calculated Property |
| Cp,gas | 842.55 | J/mol×K | 897.06 | Joback Calculated Property |
| Cp,gas | 854.03 | J/mol×K | 927.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 3-fluoro-4-trifluoromethyl-N-decyl-.
Sources
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