- InChI
- InChI=1S/C17H26ClNO/c1-3-5-6-7-8-9-14-19(4-2)17(20)15-10-12-16(18)13-11-15/h10-13H,3-9,14H2,1-2H3
- InChI Key
- ZKRCJPYLGITCOL-UHFFFAOYSA-N
- Formula
- C17H26ClNO
- SMILES
- CCCCCCCCN(CC)C(=O)c1ccc(Cl)cc1
- Molecular Weight1
- 295.85
- 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° | 164.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -229.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.55 | kJ/mol | Joback Calculated Property |
| log10WS | -5.65 | Crippen Calculated Property | |
| logPoct/wat | 5.163 | Crippen Calculated Property | |
| McVol | 250.420 | ml/mol | McGowan Calculated Property |
| Pc | 1587.28 | kPa | Joback Calculated Property |
| Inp | [2453.00; 2453.00] |
|
|
| Inp | 2453.00 | NIST | |
| Inp | 2453.00 | NIST | |
| Tboil | 723.76 | K | Joback Calculated Property |
| Tc | 921.14 | K | Joback Calculated Property |
| Tfus | 432.61 | K | Joback Calculated Property |
| Vc | 0.953 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [696.97; 783.64] | J/mol×K | [723.76; 921.14] |
|
| Cp,gas | 696.97 | J/mol×K | 723.76 | Joback Calculated Property |
| Cp,gas | 713.74 | J/mol×K | 756.66 | Joback Calculated Property |
| Cp,gas | 729.52 | J/mol×K | 789.55 | Joback Calculated Property |
| Cp,gas | 744.34 | J/mol×K | 822.45 | Joback Calculated Property |
| Cp,gas | 758.27 | J/mol×K | 855.34 | Joback Calculated Property |
| Cp,gas | 771.36 | J/mol×K | 888.24 | Joback Calculated Property |
| Cp,gas | 783.64 | J/mol×K | 921.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 4-chloro-N-ethyl-N-octyl-.
Sources
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