- InChI
- InChI=1S/C17H34ClNO/c1-3-5-7-9-11-15-19(17(20)13-14-18)16-12-10-8-6-4-2/h3-16H2,1-2H3
- InChI Key
- HMZMBEDMMYANJV-UHFFFAOYSA-N
- Formula
- C17H34ClNO
- SMILES
- CCCCCCCN(CCCCCCC)C(=O)CCCl
- Molecular Weight1
- 303.91
- 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 | 0.8609 | Relay (1.0) Calculated Property | |
| ΔfG° | 62.19 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -543.72 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 48.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.43 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.59 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.86 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.385 | Crippen Calculated Property | |
| McVol | 274.180 | ml/mol | McGowan Calculated Property |
| Pc | 1252.15 | kPa | Joback Calculated Property |
| Inp | [2166.00; 2166.00] |
|
|
| Inp | 2166.00 | NIST | |
| Inp | 2166.00 | NIST | |
| Tboil | 596.31 | K | Relay (1.0) Calculated Property |
| Tc | 797.64 | K | Relay (1.0) Calculated Property |
| Tfus | 294.51 | K | Relay (1.0) Calculated Property |
| Vc | 1.024 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [777.88; 873.68] | J/mol×K | [692.10; 863.66] |
|
| Cp,gas | 777.88 | J/mol×K | 692.10 | Joback Calculated Property |
| Cp,gas | 795.87 | J/mol×K | 720.69 | Joback Calculated Property |
| Cp,gas | 813.01 | J/mol×K | 749.29 | Joback Calculated Property |
| Cp,gas | 829.33 | J/mol×K | 777.88 | Joback Calculated Property |
| Cp,gas | 844.85 | J/mol×K | 806.47 | Joback Calculated Property |
| Cp,gas | 859.63 | J/mol×K | 835.07 | Joback Calculated Property |
| Cp,gas | 873.68 | J/mol×K | 863.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N,N-diheptyl-3-chloro-.
Sources
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