- InChI
- InChI=1S/C16H24ClNO/c1-3-5-6-7-8-13-18(4-2)16(19)14-9-11-15(17)12-10-14/h9-12H,3-8,13H2,1-2H3
- InChI Key
- IDBIVXQHJAEJKP-UHFFFAOYSA-N
- Formula
- C16H24ClNO
- SMILES
- CCCCCCCN(CC)C(=O)c1ccc(Cl)cc1
- Molecular Weight1
- 281.82
- 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° | 156.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -209.30 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.32 | kJ/mol | Joback Calculated Property |
| log10WS | -5.23 | Crippen Calculated Property | |
| logPoct/wat | 4.772 | Crippen Calculated Property | |
| McVol | 236.330 | ml/mol | McGowan Calculated Property |
| Pc | 1716.03 | kPa | Joback Calculated Property |
| Inp | [2349.00; 2349.00] |
|
|
| Inp | 2349.00 | NIST | |
| Inp | 2349.00 | NIST | |
| Tboil | 700.88 | K | Joback Calculated Property |
| Tc | 900.06 | K | Joback Calculated Property |
| Tfus | 421.34 | K | Joback Calculated Property |
| Vc | 0.896 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [641.65; 726.66] | J/mol×K | [700.88; 900.06] |
|
| Cp,gas | 641.65 | J/mol×K | 700.88 | Joback Calculated Property |
| Cp,gas | 658.12 | J/mol×K | 734.08 | Joback Calculated Property |
| Cp,gas | 673.61 | J/mol×K | 767.27 | Joback Calculated Property |
| Cp,gas | 688.16 | J/mol×K | 800.47 | Joback Calculated Property |
| Cp,gas | 701.82 | J/mol×K | 833.67 | Joback Calculated Property |
| Cp,gas | 714.63 | J/mol×K | 866.86 | Joback Calculated Property |
| Cp,gas | 726.66 | J/mol×K | 900.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 4-chloro-N-ethyl-N-heptyl-.
Sources
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