- InChI
- InChI=1S/C23H37F2NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-26-23(27)21-19-20(24)16-17-22(21)25/h16-17,19H,2-15,18H2,1H3,(H,26,27)
- InChI Key
- AYZZXPKDUBZPCX-UHFFFAOYSA-N
- Formula
- C23H37F2NO
- SMILES
-
CCCCCCCCCCCCCCCCNC(=O)c1cc(F)c
cc1F - Molecular Weight1
- 381.54
- 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 | 1.0725 | Relay (1.0) Calculated Property | |
| ΔfG° | -193.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -789.60 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 61.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.57 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.29 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.73 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.176 | Crippen Calculated Property | |
| McVol | 326.260 | ml/mol | McGowan Calculated Property |
| Pc | 1014.89 | kPa | Joback Calculated Property |
| Inp | [2799.00; 2799.00] |
|
|
| Inp | 2799.00 | NIST | |
| Inp | 2799.00 | NIST | |
| Tboil | 649.57 | K | Relay (1.0) Calculated Property |
| Tc | 878.33 | K | Relay (1.0) Calculated Property |
| Tfus | 348.61 | K | Relay (1.0) Calculated Property |
| Vc | 1.234 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1053.23; 1146.24] | J/mol×K | [864.86; 1059.83] |
|
| Cp,gas | 1053.23 | J/mol×K | 864.86 | Joback Calculated Property |
| Cp,gas | 1071.26 | J/mol×K | 897.35 | Joback Calculated Property |
| Cp,gas | 1088.21 | J/mol×K | 929.85 | Joback Calculated Property |
| Cp,gas | 1104.13 | J/mol×K | 962.34 | Joback Calculated Property |
| Cp,gas | 1119.08 | J/mol×K | 994.84 | Joback Calculated Property |
| Cp,gas | 1133.10 | J/mol×K | 1027.33 | Joback Calculated Property |
| Cp,gas | 1146.24 | J/mol×K | 1059.83 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 2,5-difluoro-N-hexadecyl-.
Sources
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