- InChI
- InChI=1S/C16H32BrNO/c1-3-4-5-6-7-8-9-12-15-18(2)16(19)13-10-11-14-17/h3-15H2,1-2H3
- InChI Key
- WJVMVKIZEGKNEQ-UHFFFAOYSA-N
- Formula
- C16H32BrNO
- SMILES
- CCCCCCCCCCN(C)C(=O)CCCCBr
- Molecular Weight1
- 334.33
- 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 | 0.8887 | Relay (1.0) Calculated Property | |
| ΔfG° | 80.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -492.58 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 47.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.68 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.87 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.59 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.151 | Crippen Calculated Property | |
| McVol | 265.350 | ml/mol | McGowan Calculated Property |
| Pc | 1452.35 | kPa | Joback Calculated Property |
| Inp | 2291.00 | NIST | |
| Tboil | 604.75 | K | Relay (1.0) Calculated Property |
| Tc | 795.84 | K | Relay (1.0) Calculated Property |
| Tfus | 303.50 | K | Relay (1.0) Calculated Property |
| Vc | 0.993 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [739.59; 831.33] | J/mol×K | [697.95; 875.62] | 
|
| Cp,gas | 739.59 | J/mol×K | 697.95 | Joback Calculated Property |
| Cp,gas | 756.88 | J/mol×K | 727.56 | Joback Calculated Property |
| Cp,gas | 773.32 | J/mol×K | 757.17 | Joback Calculated Property |
| Cp,gas | 788.95 | J/mol×K | 786.78 | Joback Calculated Property |
| Cp,gas | 803.80 | J/mol×K | 816.40 | Joback Calculated Property |
| Cp,gas | 817.91 | J/mol×K | 846.01 | Joback Calculated Property |
| Cp,gas | 831.33 | J/mol×K | 875.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentanamide, N-decyl-N-methyl-5-bromo-.
Sources
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