- InChI
- InChI=1S/C18H36BrNO/c1-3-5-7-12-16-20(17-13-8-6-4-2)18(21)14-10-9-11-15-19/h3-17H2,1-2H3
- InChI Key
- SXKOXSZLUVBISJ-UHFFFAOYSA-N
- Formula
- C18H36BrNO
- SMILES
- CCCCCCN(CCCCCC)C(=O)CCCCCBr
- Molecular Weight1
- 362.39
- 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° | 96.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -433.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 52.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.89 | kJ/mol | Joback Calculated Property |
| log10WS | -6.13 | Crippen Calculated Property | |
| logPoct/wat | 5.931 | Crippen Calculated Property | |
| McVol | 293.530 | ml/mol | McGowan Calculated Property |
| Pc | 1261.06 | kPa | Joback Calculated Property |
| Inp | [2310.00; 2310.00] |
|
|
| Inp | 2310.00 | NIST | |
| Inp | 2310.00 | NIST | |
| Tboil | 743.71 | K | Joback Calculated Property |
| Tc | 922.40 | K | Joback Calculated Property |
| Tfus | 434.82 | K | Joback Calculated Property |
| Vc | 1.129 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [855.05; 950.74] | J/mol×K | [743.71; 922.40] |
|
| Cp,gas | 855.05 | J/mol×K | 743.71 | Joback Calculated Property |
| Cp,gas | 873.10 | J/mol×K | 773.49 | Joback Calculated Property |
| Cp,gas | 890.25 | J/mol×K | 803.27 | Joback Calculated Property |
| Cp,gas | 906.54 | J/mol×K | 833.05 | Joback Calculated Property |
| Cp,gas | 922.03 | J/mol×K | 862.83 | Joback Calculated Property |
| Cp,gas | 936.75 | J/mol×K | 892.62 | Joback Calculated Property |
| Cp,gas | 950.74 | J/mol×K | 922.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexanamide, N,N-dihexyl-6-bromo-.
Sources
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