- InChI
- InChI=1S/C14H20FNO/c1-3-5-10-16(9-4-2)14(17)12-7-6-8-13(15)11-12/h6-8,11H,3-5,9-10H2,1-2H3
- InChI Key
- QLDSBBNBDRMQQG-UHFFFAOYSA-N
- Formula
- C14H20FNO
- SMILES
- CCCCN(CCC)C(=O)c1cccc(F)c1
- Molecular Weight1
- 237.31
- 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 | 0.6496 | Relay (1.0) Calculated Property | |
| ΔfG° | -43.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -404.14 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.02 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.50 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.478 | Crippen Calculated Property | |
| McVol | 197.680 | ml/mol | McGowan Calculated Property |
| Pc | 2010.90 | kPa | Joback Calculated Property |
| Inp | [2527.00; 2527.00] |
|
|
| Inp | 2527.00 | NIST | |
| Inp | 2527.00 | NIST | |
| Tboil | 577.16 | K | Relay (1.0) Calculated Property |
| Tc | 762.46 | K | Relay (1.0) Calculated Property |
| Tfus | 264.08 | K | Relay (1.0) Calculated Property |
| Vc | 0.724 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [512.73; 596.46] | J/mol×K | [616.96; 808.81] |
|
| Cp,gas | 512.73 | J/mol×K | 616.96 | Joback Calculated Property |
| Cp,gas | 528.82 | J/mol×K | 648.94 | Joback Calculated Property |
| Cp,gas | 544.01 | J/mol×K | 680.91 | Joback Calculated Property |
| Cp,gas | 558.33 | J/mol×K | 712.89 | Joback Calculated Property |
| Cp,gas | 571.82 | J/mol×K | 744.86 | Joback Calculated Property |
| Cp,gas | 584.52 | J/mol×K | 776.84 | Joback Calculated Property |
| Cp,gas | 596.46 | J/mol×K | 808.81 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 3-fluoro-N-butyl-N-propyl-.
Sources
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