- InChI
- InChI=1S/C18H36ClNO/c1-4-6-8-10-12-14-16-20(18(21)17(3)19)15-13-11-9-7-5-2/h17H,4-16H2,1-3H3
- InChI Key
- QBZXHNDGBKWEQP-UHFFFAOYSA-N
- Formula
- C18H36ClNO
- SMILES
- CCCCCCCCN(CCCCCCC)C(=O)C(C)Cl
- Molecular Weight1
- 317.94
- 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° | 68.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -480.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.45 | kJ/mol | Joback Calculated Property |
| log10WS | -5.97 | Crippen Calculated Property | |
| logPoct/wat | 5.773 | Crippen Calculated Property | |
| McVol | 288.270 | ml/mol | McGowan Calculated Property |
| Pc | 1177.66 | kPa | Joback Calculated Property |
| Inp | [2164.00; 2164.00] |
|
|
| Inp | 2164.00 | NIST | |
| Inp | 2164.00 | NIST | |
| Tboil | 714.54 | K | Joback Calculated Property |
| Tc | 888.62 | K | Joback Calculated Property |
| Tfus | 389.94 | K | Joback Calculated Property |
| Vc | 1.111 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [836.34; 934.97] | J/mol×K | [714.54; 888.62] |
|
| Cp,gas | 836.34 | J/mol×K | 714.54 | Joback Calculated Property |
| Cp,gas | 854.93 | J/mol×K | 743.55 | Joback Calculated Property |
| Cp,gas | 872.61 | J/mol×K | 772.57 | Joback Calculated Property |
| Cp,gas | 889.42 | J/mol×K | 801.58 | Joback Calculated Property |
| Cp,gas | 905.39 | J/mol×K | 830.59 | Joback Calculated Property |
| Cp,gas | 920.56 | J/mol×K | 859.60 | Joback Calculated Property |
| Cp,gas | 934.97 | J/mol×K | 888.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N-heptyl-N-octyl-2-chloro-.
Sources
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