- InChI
- InChI=1S/C15H22ClNO/c1-3-5-6-7-12-17(4-2)15(18)13-8-10-14(16)11-9-13/h8-11H,3-7,12H2,1-2H3
- InChI Key
- VQMKLZIXOHZRIZ-UHFFFAOYSA-N
- Formula
- C15H22ClNO
- SMILES
- CCCCCCN(CC)C(=O)c1ccc(Cl)cc1
- Molecular Weight1
- 267.79
- 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° | 148.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -188.66 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.10 | kJ/mol | Joback Calculated Property |
| log10WS | -4.81 | Crippen Calculated Property | |
| logPoct/wat | 4.382 | Crippen Calculated Property | |
| McVol | 222.240 | ml/mol | McGowan Calculated Property |
| Pc | 1861.11 | kPa | Joback Calculated Property |
| Inp | [2143.00; 2143.00] |
|
|
| Inp | 2143.00 | NIST | |
| Inp | 2143.00 | NIST | |
| Tboil | 678.00 | K | Joback Calculated Property |
| Tc | 879.41 | K | Joback Calculated Property |
| Tfus | 410.07 | K | Joback Calculated Property |
| Vc | 0.841 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [587.50; 670.61] | J/mol×K | [678.00; 879.41] |
|
| Cp,gas | 587.50 | J/mol×K | 678.00 | Joback Calculated Property |
| Cp,gas | 603.63 | J/mol×K | 711.57 | Joback Calculated Property |
| Cp,gas | 618.79 | J/mol×K | 745.14 | Joback Calculated Property |
| Cp,gas | 633.02 | J/mol×K | 778.71 | Joback Calculated Property |
| Cp,gas | 646.37 | J/mol×K | 812.28 | Joback Calculated Property |
| Cp,gas | 658.89 | J/mol×K | 845.85 | Joback Calculated Property |
| Cp,gas | 670.61 | J/mol×K | 879.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 4-chloro-N-ethyl-N-hexyl-.
Sources
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