- InChI
- InChI=1S/C15H22FNO/c1-3-5-6-9-12-17(4-2)15(18)13-10-7-8-11-14(13)16/h7-8,10-11H,3-6,9,12H2,1-2H3
- InChI Key
- RIVAFBKULSKXQV-UHFFFAOYSA-N
- Formula
- C15H22FNO
- SMILES
- CCCCCCN(CC)C(=O)c1ccccc1F
- Molecular Weight1
- 251.34
- 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 | 0.6834 | Relay (1.0) Calculated Property | |
| ΔfG° | -34.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -434.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 35.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.47 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.42 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.868 | Crippen Calculated Property | |
| McVol | 211.770 | ml/mol | McGowan Calculated Property |
| Pc | 1848.33 | kPa | Joback Calculated Property |
| Inp | [2027.00; 2027.00] |
|
|
| Inp | 2027.00 | NIST | |
| Inp | 2027.00 | NIST | |
| Tboil | 583.26 | K | Relay (1.0) Calculated Property |
| Tc | 780.21 | K | Relay (1.0) Calculated Property |
| Tfus | 274.20 | K | Relay (1.0) Calculated Property |
| Vc | 0.781 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [565.06; 651.11] | J/mol×K | [639.84; 829.64] |
|
| Cp,gas | 565.06 | J/mol×K | 639.84 | Joback Calculated Property |
| Cp,gas | 581.58 | J/mol×K | 671.47 | Joback Calculated Property |
| Cp,gas | 597.17 | J/mol×K | 703.11 | Joback Calculated Property |
| Cp,gas | 611.88 | J/mol×K | 734.74 | Joback Calculated Property |
| Cp,gas | 625.75 | J/mol×K | 766.37 | Joback Calculated Property |
| Cp,gas | 638.81 | J/mol×K | 798.01 | Joback Calculated Property |
| Cp,gas | 651.11 | J/mol×K | 829.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 2-fluoro-N-ethyl-N-hexyl-.
Sources
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