- InChI
- InChI=1S/C12H24BrNO/c1-2-3-4-5-6-7-8-9-10-14-12(15)11-13/h2-11H2,1H3,(H,14,15)
- InChI Key
- RZTGBAJAVREPOB-UHFFFAOYSA-N
- Formula
- C12H24BrNO
- SMILES
- CCCCCCCCCCNC(=O)CBr
- Molecular Weight1
- 278.23
- 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 | 0.8048 | Relay (1.0) Calculated Property | |
| ΔfG° | 24.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -431.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 38.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.56 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.42 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.26 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.638 | Crippen Calculated Property | |
| McVol | 208.990 | ml/mol | McGowan Calculated Property |
| Pc | 2019.95 | kPa | Joback Calculated Property |
| Inp | [1915.00; 1915.00] |
|
|
| Inp | 1915.00 | NIST | |
| Inp | 1915.00 | NIST | |
| Tboil | 578.63 | K | Relay (1.0) Calculated Property |
| Tc | 785.63 | K | Relay (1.0) Calculated Property |
| Tfus | 319.93 | K | Relay (1.0) Calculated Property |
| Vc | 0.773 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [540.43; 619.39] | J/mol×K | [644.16; 828.65] |
|
| Cp,gas | 540.43 | J/mol×K | 644.16 | Joback Calculated Property |
| Cp,gas | 555.34 | J/mol×K | 674.91 | Joback Calculated Property |
| Cp,gas | 569.52 | J/mol×K | 705.66 | Joback Calculated Property |
| Cp,gas | 582.98 | J/mol×K | 736.40 | Joback Calculated Property |
| Cp,gas | 595.76 | J/mol×K | 767.15 | Joback Calculated Property |
| Cp,gas | 607.88 | J/mol×K | 797.90 | Joback Calculated Property |
| Cp,gas | 619.39 | J/mol×K | 828.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Bromacetamide, N-decyl-.
Sources
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