- InChI
- InChI=1S/C15H23NO/c1-4-6-12-16(11-5-2)15(17)14-9-7-13(3)8-10-14/h7-10H,4-6,11-12H2,1-3H3
- InChI Key
- CHUDVKHJQQDKFM-UHFFFAOYSA-N
- Formula
- C15H23NO
- SMILES
- CCCCN(CCC)C(=O)c1ccc(C)cc1
- Molecular Weight1
- 233.35
- 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 | 0.6841 | Relay (1.0) Calculated Property | |
| ΔfG° | 160.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -236.73 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 32.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.54 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.99 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.05 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.647 | Crippen Calculated Property | |
| McVol | 210.000 | ml/mol | McGowan Calculated Property |
| Pc | 1921.98 | kPa | Joback Calculated Property |
| Inp | 2914.00 | NIST | |
| Tboil | 600.34 | K | Relay (1.0) Calculated Property |
| Tc | 782.28 | K | Relay (1.0) Calculated Property |
| Tfus | 285.43 | K | Relay (1.0) Calculated Property |
| Vc | 0.775 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [557.07; 646.58] | J/mol×K | [640.57; 838.24] | 
|
| Cp,gas | 557.07 | J/mol×K | 640.57 | Joback Calculated Property |
| Cp,gas | 574.31 | J/mol×K | 673.52 | Joback Calculated Property |
| Cp,gas | 590.57 | J/mol×K | 706.46 | Joback Calculated Property |
| Cp,gas | 605.88 | J/mol×K | 739.41 | Joback Calculated Property |
| Cp,gas | 620.29 | J/mol×K | 772.35 | Joback Calculated Property |
| Cp,gas | 633.84 | J/mol×K | 805.30 | Joback Calculated Property |
| Cp,gas | 646.58 | J/mol×K | 838.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 4-methyl-N-butyl-N-propyl-.
Sources
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