- InChI
- InChI=1S/C17H26ClNO/c1-2-3-4-5-6-7-8-11-14-19-17(20)15-12-9-10-13-16(15)18/h9-10,12-13H,2-8,11,14H2,1H3,(H,19,20)
- InChI Key
- DHWFCIRYWTTYQL-UHFFFAOYSA-N
- Formula
- C17H26ClNO
- SMILES
- CCCCCCCCCCNC(=O)c1ccccc1Cl
- 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° | 143.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -244.00 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.94 | kJ/mol | Joback Calculated Property |
| log10WS | -6.27 | Crippen Calculated Property | |
| logPoct/wat | 5.210 | Crippen Calculated Property | |
| McVol | 250.420 | ml/mol | McGowan Calculated Property |
| Pc | 1606.42 | kPa | Joback Calculated Property |
| Inp | [2421.00; 2421.00] |
|
|
| Inp | 2421.00 | NIST | |
| Inp | 2421.00 | NIST | |
| Tboil | 761.49 | K | Joback Calculated Property |
| Tc | 962.02 | K | Joback Calculated Property |
| Tfus | 452.80 | K | Joback Calculated Property |
| Vc | 0.970 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [714.50; 796.72] | J/mol×K | [761.49; 962.02] |
|
| Cp,gas | 714.50 | J/mol×K | 761.49 | Joback Calculated Property |
| Cp,gas | 730.47 | J/mol×K | 794.91 | Joback Calculated Property |
| Cp,gas | 745.48 | J/mol×K | 828.33 | Joback Calculated Property |
| Cp,gas | 759.56 | J/mol×K | 861.75 | Joback Calculated Property |
| Cp,gas | 772.76 | J/mol×K | 895.17 | Joback Calculated Property |
| Cp,gas | 785.13 | J/mol×K | 928.59 | Joback Calculated Property |
| Cp,gas | 796.72 | J/mol×K | 962.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 2-chloro-N-decyl-.
Sources
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