- InChI
- InChI=1S/C16H20F5NO/c1-2-3-4-5-6-7-8-9-22-16(23)10-11(17)13(19)15(21)14(20)12(10)18/h2-9H2,1H3,(H,22,23)
- InChI Key
- JXYQQTHELUBGTI-UHFFFAOYSA-N
- Formula
- C16H20F5NO
- SMILES
-
CCCCCCCCCNC(=O)c1c(F)c(F)c(F)c
(F)c1F - Molecular Weight1
- 337.33
- 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 | 0.8645 | Relay (1.0) Calculated Property | |
| ΔfG° | -865.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1055.63 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 51.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.87 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.43 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.05 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.862 | Crippen Calculated Property | |
| McVol | 232.940 | ml/mol | McGowan Calculated Property |
| Pc | 1427.22 | kPa | Joback Calculated Property |
| Inp | [1996.00; 1996.00] |
|
|
| Inp | 1996.00 | NIST | |
| Inp | 1996.00 | NIST | |
| Tboil | 576.68 | K | Relay (1.0) Calculated Property |
| Tc | 784.39 | K | Relay (1.0) Calculated Property |
| Tfus | 338.04 | K | Relay (1.0) Calculated Property |
| Vc | 0.875 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [666.27; 738.44] | J/mol×K | [717.45; 891.18] |
|
| Cp,gas | 666.27 | J/mol×K | 717.45 | Joback Calculated Property |
| Cp,gas | 679.96 | J/mol×K | 746.41 | Joback Calculated Property |
| Cp,gas | 692.96 | J/mol×K | 775.36 | Joback Calculated Property |
| Cp,gas | 705.30 | J/mol×K | 804.32 | Joback Calculated Property |
| Cp,gas | 716.98 | J/mol×K | 833.27 | Joback Calculated Property |
| Cp,gas | 728.02 | J/mol×K | 862.23 | Joback Calculated Property |
| Cp,gas | 738.44 | J/mol×K | 891.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, pentafluoro-N-nonyl-.
Sources
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