- InChI
- InChI=1S/C21H32F3NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-25-21(26)17-14-15-18(22)20(24)19(17)23/h14-15H,2-13,16H2,1H3,(H,25,26)
- InChI Key
- QYRBCIBBXDLNQE-UHFFFAOYSA-N
- Formula
- C21H32F3NO
- SMILES
-
CCCCCCCCCCCCCCNC(=O)c1ccc(F)c(
F)c1F - Molecular Weight1
- 371.48
- 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° | -414.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -922.09 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.33 | kJ/mol | Joback Calculated Property |
| log10WS | -8.25 | Crippen Calculated Property | |
| logPoct/wat | 6.535 | Crippen Calculated Property | |
| McVol | 299.850 | ml/mol | McGowan Calculated Property |
| Pc | 1105.94 | kPa | Joback Calculated Property |
| Inp | [2554.00; 2554.00] |
|
|
| Inp | 2554.00 | NIST | |
| Inp | 2554.00 | NIST | |
| Tboil | 823.35 | K | Joback Calculated Property |
| Tc | 1010.90 | K | Joback Calculated Property |
| Tfus | 494.77 | K | Joback Calculated Property |
| Vc | 1.198 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [939.07; 1026.45] | J/mol×K | [823.35; 1010.90] |
|
| Cp,gas | 939.07 | J/mol×K | 823.35 | Joback Calculated Property |
| Cp,gas | 955.92 | J/mol×K | 854.61 | Joback Calculated Property |
| Cp,gas | 971.81 | J/mol×K | 885.87 | Joback Calculated Property |
| Cp,gas | 986.77 | J/mol×K | 917.12 | Joback Calculated Property |
| Cp,gas | 1000.83 | J/mol×K | 948.38 | Joback Calculated Property |
| Cp,gas | 1014.05 | J/mol×K | 979.64 | Joback Calculated Property |
| Cp,gas | 1026.45 | J/mol×K | 1010.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 2,3,4-trifluoro-N-tetradecyl-.
Sources
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