- InChI
- InChI=1S/C16H32ClNO/c1-4-7-11-15(5-2)14-18(6-3)16(19)12-9-8-10-13-17/h15H,4-14H2,1-3H3
- InChI Key
- SFMJHCLAXLVSGA-UHFFFAOYSA-N
- Formula
- C16H32ClNO
- SMILES
- CCCCC(CC)CN(CC)C(=O)CCCCCCl
- Molecular Weight1
- 289.88
- 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 | 0.7690 | Relay (1.0) Calculated Property | |
| ΔfG° | 51.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -534.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 42.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.38 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.851 | Crippen Calculated Property | |
| McVol | 260.090 | ml/mol | McGowan Calculated Property |
| Pc | 1349.66 | kPa | Joback Calculated Property |
| Inp | [2176.00; 2176.00] |
|
|
| Inp | 2176.00 | NIST | |
| Inp | 2176.00 | NIST | |
| Tboil | 582.16 | K | Relay (1.0) Calculated Property |
| Tc | 786.14 | K | Relay (1.0) Calculated Property |
| Tfus | 250.31 | K | Relay (1.0) Calculated Property |
| Vc | 0.937 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [721.40; 816.28] | J/mol×K | [668.78; 842.13] |
|
| Cp,gas | 721.40 | J/mol×K | 668.78 | Joback Calculated Property |
| Cp,gas | 739.24 | J/mol×K | 697.67 | Joback Calculated Property |
| Cp,gas | 756.23 | J/mol×K | 726.56 | Joback Calculated Property |
| Cp,gas | 772.40 | J/mol×K | 755.45 | Joback Calculated Property |
| Cp,gas | 787.78 | J/mol×K | 784.34 | Joback Calculated Property |
| Cp,gas | 802.39 | J/mol×K | 813.24 | Joback Calculated Property |
| Cp,gas | 816.28 | J/mol×K | 842.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexanamide, 6-chloro-N-ethyl-N-2-ethylhexyl-.
Sources
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