- InChI
- InChI=1S/C17H34BrNO/c1-3-5-7-9-11-13-15-19(17(20)16-18)14-12-10-8-6-4-2/h3-16H2,1-2H3
- InChI Key
- QLRLBCAQISQMGS-UHFFFAOYSA-N
- Formula
- C17H34BrNO
- SMILES
- CCCCCCCCN(CCCCCCC)C(=O)CBr
- Molecular Weight1
- 348.36
- 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 | 0.9126 | Relay (1.0) Calculated Property | |
| ΔfG° | 88.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -501.65 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 49.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.67 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.36 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.541 | Crippen Calculated Property | |
| McVol | 279.440 | ml/mol | McGowan Calculated Property |
| Pc | 1351.64 | kPa | Joback Calculated Property |
| Inp | [2262.00; 2262.00] |
|
|
| Inp | 2262.00 | NIST | |
| Inp | 2262.00 | NIST | |
| Tboil | 607.89 | K | Relay (1.0) Calculated Property |
| Tc | 806.32 | K | Relay (1.0) Calculated Property |
| Tfus | 297.27 | K | Relay (1.0) Calculated Property |
| Vc | 1.042 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [796.79; 890.52] | J/mol×K | [720.83; 898.74] |
|
| Cp,gas | 796.79 | J/mol×K | 720.83 | Joback Calculated Property |
| Cp,gas | 814.46 | J/mol×K | 750.48 | Joback Calculated Property |
| Cp,gas | 831.25 | J/mol×K | 780.13 | Joback Calculated Property |
| Cp,gas | 847.22 | J/mol×K | 809.79 | Joback Calculated Property |
| Cp,gas | 862.39 | J/mol×K | 839.44 | Joback Calculated Property |
| Cp,gas | 876.81 | J/mol×K | 869.09 | Joback Calculated Property |
| Cp,gas | 890.52 | J/mol×K | 898.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Bromoacetamide, N-heptyl-N-octyl-.
Sources
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