- InChI
- InChI=1S/C21H42ClNO/c1-4-6-8-10-12-14-16-18-23(21(24)20(3)22)19-17-15-13-11-9-7-5-2/h20H,4-19H2,1-3H3
- InChI Key
- CAYVAIPTSFKUIT-UHFFFAOYSA-N
- Formula
- C21H42ClNO
- SMILES
-
CCCCCCCCCN(CCCCCCCCC)C(=O)C(C)
Cl - Molecular Weight1
- 360.02
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.9563 | Relay (1.0) Calculated Property | |
| ΔfG° | 93.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -641.92 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 55.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.69 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.50 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.944 | Crippen Calculated Property | |
| McVol | 330.540 | ml/mol | McGowan Calculated Property |
| Pc | 975.34 | kPa | Joback Calculated Property |
| Inp | [2471.00; 2471.00] |
|
|
| Inp | 2471.00 | NIST | |
| Inp | 2471.00 | NIST | |
| Tboil | 604.96 | K | Relay (1.0) Calculated Property |
| Tc | 814.55 | K | Relay (1.0) Calculated Property |
| Tfus | 310.59 | K | Relay (1.0) Calculated Property |
| Vc | 1.257 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1016.38; 1120.70] | J/mol×K | [783.18; 962.53] |
|
| Cp,gas | 1016.38 | J/mol×K | 783.18 | Joback Calculated Property |
| Cp,gas | 1036.14 | J/mol×K | 813.07 | Joback Calculated Property |
| Cp,gas | 1054.89 | J/mol×K | 842.96 | Joback Calculated Property |
| Cp,gas | 1072.68 | J/mol×K | 872.85 | Joback Calculated Property |
| Cp,gas | 1089.54 | J/mol×K | 902.75 | Joback Calculated Property |
| Cp,gas | 1105.54 | J/mol×K | 932.64 | Joback Calculated Property |
| Cp,gas | 1120.70 | J/mol×K | 962.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N,N-dinonyl-2-chloro-.
Sources
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