- InChI
- InChI=1S/C19H25F6NO/c1-2-3-4-5-6-7-8-9-12-26-17(27)15-13-14(18(20,21)22)10-11-16(15)19(23,24)25/h10-11,13H,2-9,12H2,1H3,(H,26,27)
- InChI Key
- PPBFEHKUQLYERX-UHFFFAOYSA-N
- Formula
- C19H25F6NO
- SMILES
-
CCCCCCCCCCNC(=O)c1cc(C(F)(F)F)
ccc1C(F)(F)F - Molecular Weight1
- 397.40
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.9215 | Relay (1.0) Calculated Property | |
| ΔfG° | -1000.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1582.19 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 48.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.15 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.42 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.11 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.595 | Crippen Calculated Property | |
| McVol | 276.980 | ml/mol | McGowan Calculated Property |
| Pc | 1191.52 | kPa | Joback Calculated Property |
| Inp | 2045.00 | NIST | |
| Tboil | 606.68 | K | Relay (1.0) Calculated Property |
| Tc | 831.84 | K | Relay (1.0) Calculated Property |
| Tfus | 362.52 | K | Relay (1.0) Calculated Property |
| Vc | 1.049 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [847.87; 926.45] | J/mol×K | [763.96; 943.31] | 
|
| Cp,gas | 847.87 | J/mol×K | 763.96 | Joback Calculated Property |
| Cp,gas | 862.99 | J/mol×K | 793.85 | Joback Calculated Property |
| Cp,gas | 877.23 | J/mol×K | 823.74 | Joback Calculated Property |
| Cp,gas | 890.64 | J/mol×K | 853.64 | Joback Calculated Property |
| Cp,gas | 903.27 | J/mol×K | 883.53 | Joback Calculated Property |
| Cp,gas | 915.19 | J/mol×K | 913.42 | Joback Calculated Property |
| Cp,gas | 926.45 | J/mol×K | 943.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 2,5-di(trifluoromethyl)-N-decyl-.
Sources
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