- InChI
- InChI=1S/C22H44BrNO/c1-3-5-7-9-11-13-15-17-19-24(22(25)21-23)20-18-16-14-12-10-8-6-4-2/h3-21H2,1-2H3
- InChI Key
- FPPRCDPCFMKQPQ-UHFFFAOYSA-N
- Formula
- C22H44BrNO
- SMILES
-
CCCCCCCCCCN(CCCCCCCCCC)C(=O)CB
r - Molecular Weight1
- 418.50
- 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 | 1.0883 | Relay (1.0) Calculated Property | |
| ΔfG° | 130.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -609.33 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 62.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.86 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.04 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.491 | Crippen Calculated Property | |
| McVol | 349.890 | ml/mol | McGowan Calculated Property |
| Pc | 976.56 | kPa | Joback Calculated Property |
| Inp | [2776.00; 2776.00] |
|
|
| Inp | 2776.00 | NIST | |
| Inp | 2776.00 | NIST | |
| Tboil | 640.68 | K | Relay (1.0) Calculated Property |
| Tc | 839.76 | K | Relay (1.0) Calculated Property |
| Tfus | 320.73 | K | Relay (1.0) Calculated Property |
| Vc | 1.321 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1097.39; 1201.75] | J/mol×K | [835.23; 1023.47] |
|
| Cp,gas | 1097.39 | J/mol×K | 835.23 | Joback Calculated Property |
| Cp,gas | 1117.17 | J/mol×K | 866.60 | Joback Calculated Property |
| Cp,gas | 1135.92 | J/mol×K | 897.98 | Joback Calculated Property |
| Cp,gas | 1153.69 | J/mol×K | 929.35 | Joback Calculated Property |
| Cp,gas | 1170.55 | J/mol×K | 960.72 | Joback Calculated Property |
| Cp,gas | 1186.55 | J/mol×K | 992.10 | Joback Calculated Property |
| Cp,gas | 1201.75 | J/mol×K | 1023.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Bromoacetamide, N,N-didecyl-.
Sources
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