- InChI
- InChI=1S/C10H20BrNO/c1-3-5-6-9(4-2)8-12-10(13)7-11/h9H,3-8H2,1-2H3,(H,12,13)
- InChI Key
- FTYPZJUOXZNGDV-UHFFFAOYSA-N
- Formula
- C10H20BrNO
- SMILES
- CCCCC(CC)CN=C(O)CBr
- Molecular Weight1
- 250.18
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 0.8018 | Relay (... Calculated Property | |
| ΔfG° | -13.95 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -388.64 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 89.09 | kJ/mol | Relay (... Calculated Property |
| IE | 9.09 | eV | Relay (... Calculated Property |
| log10WS | -3.51 | Relay (... Calculated Property | |
| logPoct/wat | 3.554 | Crippen Calculated Property | |
| McVol | 180.810 | ml/mol | McGowan Calculated Property |
| Pc | 2248.26 | kPa | Joback Calculated Property |
| Inp | [1610.00; 1610.00] |
|
|
| Inp | 1610.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Tboil | 580.42 | K | Relay (... Calculated Property |
| Tc | 759.20 | K | Relay (... Calculated Property |
| Tfus | 283.13 | K | Relay (... Calculated Property |
| Vc | 0.609 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Bromacetamide, N-(2-ethylhexyl)-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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