- InChI
- InChI=1S/C30H50F3NO/c1-3-5-7-9-11-13-15-17-21-25-34(26-22-18-16-14-12-10-8-6-4-2)29(35)27-23-19-20-24-28(27)30(31,32)33/h19-20,23-24H,3-18,21-22,25-26H2,1-2H3
- InChI Key
- QXDTZGGCSHEQPV-UHFFFAOYSA-N
- Formula
- C30H50F3NO
- SMILES
-
CCCCCCCCCCCN(CCCCCCCCCCC)C(=O)
c1ccccc1C(F)(F)F - Molecular Weight1
- 497.72
- 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° | -295.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1079.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 73.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.35 | kJ/mol | Joback Calculated Property |
| log10WS | -11.09 | Crippen Calculated Property | |
| logPoct/wat | 10.209 | Crippen Calculated Property | |
| McVol | 426.660 | ml/mol | McGowan Calculated Property |
| Pc | 679.23 | kPa | Joback Calculated Property |
| Inp | [3216.00; 3216.00] |
|
|
| Inp | 3216.00 | NIST | |
| Inp | 3216.00 | NIST | |
| Tboil | 978.35 | K | Joback Calculated Property |
| Tc | 1207.23 | K | Joback Calculated Property |
| Tfus | 553.39 | K | Joback Calculated Property |
| Vc | 1.675 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1482.24; 1599.94] | J/mol×K | [978.35; 1207.23] |
|
| Cp,gas | 1482.24 | J/mol×K | 978.35 | Joback Calculated Property |
| Cp,gas | 1504.79 | J/mol×K | 1016.50 | Joback Calculated Property |
| Cp,gas | 1525.96 | J/mol×K | 1054.64 | Joback Calculated Property |
| Cp,gas | 1545.91 | J/mol×K | 1092.79 | Joback Calculated Property |
| Cp,gas | 1564.79 | J/mol×K | 1130.94 | Joback Calculated Property |
| Cp,gas | 1582.75 | J/mol×K | 1169.09 | Joback Calculated Property |
| Cp,gas | 1599.94 | J/mol×K | 1207.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N,N-diundecyl-2-trifluoromethyl-.
Sources
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