- InChI
- InChI=1S/C14H28BrNO/c1-4-5-6-7-8-9-10-11-12-16(3)14(17)13(2)15/h13H,4-12H2,1-3H3
- InChI Key
- FMDRHBOLGGPUBM-UHFFFAOYSA-N
- Formula
- C14H28BrNO
- SMILES
- CCCCCCCCCCN(C)C(=O)C(C)Br
- Molecular Weight1
- 306.28
- 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° | 60.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -356.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.59 | kJ/mol | Joback Calculated Property |
| log10WS | -4.57 | Crippen Calculated Property | |
| logPoct/wat | 4.369 | Crippen Calculated Property | |
| McVol | 237.170 | ml/mol | McGowan Calculated Property |
| Pc | 1701.90 | kPa | Joback Calculated Property |
| Inp | [1967.00; 1967.00] |
|
|
| Inp | 1967.00 | NIST | |
| Inp | 1967.00 | NIST | |
| Tboil | 651.75 | K | Joback Calculated Property |
| Tc | 833.02 | K | Joback Calculated Property |
| Tfus | 374.74 | K | Joback Calculated Property |
| Vc | 0.899 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [629.13; 717.84] | J/mol×K | [651.75; 833.02] |
|
| Cp,gas | 629.13 | J/mol×K | 651.75 | Joback Calculated Property |
| Cp,gas | 645.90 | J/mol×K | 681.96 | Joback Calculated Property |
| Cp,gas | 661.83 | J/mol×K | 712.17 | Joback Calculated Property |
| Cp,gas | 676.95 | J/mol×K | 742.38 | Joback Calculated Property |
| Cp,gas | 691.30 | J/mol×K | 772.60 | Joback Calculated Property |
| Cp,gas | 704.92 | J/mol×K | 802.81 | Joback Calculated Property |
| Cp,gas | 717.84 | J/mol×K | 833.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanamide, n-decyl-N-methyl-2-bromo-.
Sources
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