- InChI
- InChI=1S/C17H34ClNO/c1-4-6-8-10-12-14-19(17(20)16(3)18)15-13-11-9-7-5-2/h16H,4-15H2,1-3H3
- InChI Key
- UYMKAUWTCKPFKN-UHFFFAOYSA-N
- Formula
- C17H34ClNO
- SMILES
- CCCCCCCN(CCCCCCC)C(=O)C(C)Cl
- 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 | 0.8144 | Relay (1.0) Calculated Property | |
| ΔfG° | 59.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -555.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.17 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.55 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.09 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.383 | Crippen Calculated Property | |
| McVol | 274.180 | ml/mol | McGowan Calculated Property |
| Pc | 1259.27 | kPa | Joback Calculated Property |
| Inp | [2065.00; 2065.00] |
|
|
| Inp | 2065.00 | NIST | |
| Inp | 2065.00 | NIST | |
| Tboil | 576.97 | K | Relay (1.0) Calculated Property |
| Tc | 780.74 | K | Relay (1.0) Calculated Property |
| Tfus | 293.61 | K | Relay (1.0) Calculated Property |
| Vc | 1.031 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [778.31; 875.10] | J/mol×K | [691.66; 865.13] |
|
| Cp,gas | 778.31 | J/mol×K | 691.66 | Joback Calculated Property |
| Cp,gas | 796.53 | J/mol×K | 720.57 | Joback Calculated Property |
| Cp,gas | 813.87 | J/mol×K | 749.48 | Joback Calculated Property |
| Cp,gas | 830.36 | J/mol×K | 778.39 | Joback Calculated Property |
| Cp,gas | 846.04 | J/mol×K | 807.31 | Joback Calculated Property |
| Cp,gas | 860.94 | J/mol×K | 836.22 | Joback Calculated Property |
| Cp,gas | 875.10 | J/mol×K | 865.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, N,N-diheptyl-2-chloro-.
Sources
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