- InChI
- InChI=1S/C18H28FNO/c1-3-5-7-8-9-14-20(13-6-4-2)18(21)16-11-10-12-17(19)15-16/h10-12,15H,3-9,13-14H2,1-2H3
- InChI Key
- NYWKUKFOMXPTBQ-UHFFFAOYSA-N
- Formula
- C18H28FNO
- SMILES
- CCCCCCCN(CCCC)C(=O)c1cccc(F)c1
- Molecular Weight1
- 293.42
- 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° | -9.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -430.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.57 | kJ/mol | Joback Calculated Property |
| log10WS | -5.71 | Crippen Calculated Property | |
| logPoct/wat | 5.038 | Crippen Calculated Property | |
| McVol | 254.040 | ml/mol | McGowan Calculated Property |
| Pc | 1463.49 | kPa | Joback Calculated Property |
| Inp | [2389.00; 2389.00] |
|
|
| Inp | 2389.00 | NIST | |
| Inp | 2389.00 | NIST | |
| Tboil | 708.48 | K | Joback Calculated Property |
| Tc | 894.30 | K | Joback Calculated Property |
| Tfus | 414.55 | K | Joback Calculated Property |
| Vc | 0.978 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [729.70; 821.17] | J/mol×K | [708.48; 894.30] |
|
| Cp,gas | 729.70 | J/mol×K | 708.48 | Joback Calculated Property |
| Cp,gas | 747.21 | J/mol×K | 739.45 | Joback Calculated Property |
| Cp,gas | 763.76 | J/mol×K | 770.42 | Joback Calculated Property |
| Cp,gas | 779.39 | J/mol×K | 801.39 | Joback Calculated Property |
| Cp,gas | 794.14 | J/mol×K | 832.36 | Joback Calculated Property |
| Cp,gas | 808.05 | J/mol×K | 863.33 | Joback Calculated Property |
| Cp,gas | 821.17 | J/mol×K | 894.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 3-fluoro-N-butyl-N-heptyl-.
Sources
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