- InChI
- InChI=1S/C15H18F5NO/c1-3-5-6-8(4-2)7-21-15(22)9-10(16)12(18)14(20)13(19)11(9)17/h8H,3-7H2,1-2H3,(H,21,22)
- InChI Key
- KIPJFMIOOGOLNP-UHFFFAOYSA-N
- Formula
- C15H18F5NO
- SMILES
-
CCCCC(CC)CNC(=O)c1c(F)c(F)c(F)
c(F)c1F - Molecular Weight1
- 323.30
- 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° | -876.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1218.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.28 | kJ/mol | Joback Calculated Property |
| log10WS | -6.16 | Crippen Calculated Property | |
| logPoct/wat | 4.328 | Crippen Calculated Property | |
| McVol | 218.850 | ml/mol | McGowan Calculated Property |
| Pc | 1546.35 | kPa | Joback Calculated Property |
| Inp | [1802.00; 1802.00] |
|
|
| Inp | 1802.00 | NIST | |
| Inp | 1802.00 | NIST | |
| Tboil | 694.13 | K | Joback Calculated Property |
| Tc | 869.09 | K | Joback Calculated Property |
| Tfus | 438.37 | K | Joback Calculated Property |
| Vc | 0.892 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [612.65; 682.89] | J/mol×K | [694.13; 869.09] |
|
| Cp,gas | 612.65 | J/mol×K | 694.13 | Joback Calculated Property |
| Cp,gas | 625.97 | J/mol×K | 723.29 | Joback Calculated Property |
| Cp,gas | 638.63 | J/mol×K | 752.45 | Joback Calculated Property |
| Cp,gas | 650.64 | J/mol×K | 781.61 | Joback Calculated Property |
| Cp,gas | 662.01 | J/mol×K | 810.77 | Joback Calculated Property |
| Cp,gas | 672.75 | J/mol×K | 839.93 | Joback Calculated Property |
| Cp,gas | 682.89 | J/mol×K | 869.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, pentafluoro-N-(2-ethylhexyl)-.
Sources
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