- InChI
- InChI=1S/C23H36F3NO/c1-3-5-7-9-11-15-19-27(18-14-10-8-6-4-2)22(28)20-16-12-13-17-21(20)23(24,25)26/h12-13,16-17H,3-11,14-15,18-19H2,1-2H3
- InChI Key
- JGCKNLMKRNCRLN-UHFFFAOYSA-N
- Formula
- C23H36F3NO
- SMILES
-
CCCCCCCCN(CCCCCCC)C(=O)c1ccccc
1C(F)(F)F - Molecular Weight1
- 399.53
- 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° | -354.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -935.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.77 | kJ/mol | Joback Calculated Property |
| log10WS | -8.16 | Crippen Calculated Property | |
| logPoct/wat | 7.479 | Crippen Calculated Property | |
| McVol | 328.030 | ml/mol | McGowan Calculated Property |
| Pc | 998.28 | kPa | Joback Calculated Property |
| Inp | [2423.00; 2423.00] |
|
|
| Inp | 2423.00 | NIST | |
| Inp | 2423.00 | NIST | |
| Tboil | 818.19 | K | Joback Calculated Property |
| Tc | 1005.06 | K | Joback Calculated Property |
| Tfus | 474.50 | K | Joback Calculated Property |
| Vc | 1.282 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1040.60; 1136.28] | J/mol×K | [818.19; 1005.06] |
|
| Cp,gas | 1040.60 | J/mol×K | 818.19 | Joback Calculated Property |
| Cp,gas | 1058.92 | J/mol×K | 849.33 | Joback Calculated Property |
| Cp,gas | 1076.20 | J/mol×K | 880.48 | Joback Calculated Property |
| Cp,gas | 1092.51 | J/mol×K | 911.62 | Joback Calculated Property |
| Cp,gas | 1107.91 | J/mol×K | 942.77 | Joback Calculated Property |
| Cp,gas | 1122.48 | J/mol×K | 973.91 | Joback Calculated Property |
| Cp,gas | 1136.28 | J/mol×K | 1005.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-heptyl-N-octyl-2-trifluoromethyl-.
Sources
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