- InChI
- InChI=1S/C20H39NO/c1-5-7-9-11-13-15-17-21(20(22)18-19(3)4)16-14-12-10-8-6-2/h18H,5-17H2,1-4H3
- InChI Key
- HONXCGAHADSTFL-UHFFFAOYSA-N
- Formula
- C20H39NO
- SMILES
- CCCCCCCCN(CCCCCCC)C(=O)C=C(C)C
- Molecular Weight1
- 309.53
- 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° | 171.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -393.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 51.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.94 | kJ/mol | Joback Calculated Property |
| log10WS | -6.39 | Crippen Calculated Property | |
| logPoct/wat | 6.112 | Crippen Calculated Property | |
| McVol | 299.910 | ml/mol | McGowan Calculated Property |
| Pc | 1096.44 | kPa | Joback Calculated Property |
| Inp | 2195.00 | NIST | |
| Tboil | 727.35 | K | Joback Calculated Property |
| Tc | 901.72 | K | Joback Calculated Property |
| Tfus | 378.52 | K | Joback Calculated Property |
| Vc | 1.161 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [895.40; 1000.18] | J/mol×K | [727.35; 901.72] | 
|
| Cp,gas | 895.40 | J/mol×K | 727.35 | Joback Calculated Property |
| Cp,gas | 915.06 | J/mol×K | 756.41 | Joback Calculated Property |
| Cp,gas | 933.77 | J/mol×K | 785.47 | Joback Calculated Property |
| Cp,gas | 951.60 | J/mol×K | 814.53 | Joback Calculated Property |
| Cp,gas | 968.58 | J/mol×K | 843.60 | Joback Calculated Property |
| Cp,gas | 984.76 | J/mol×K | 872.66 | Joback Calculated Property |
| Cp,gas | 1000.18 | J/mol×K | 901.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to But-2-enamide, N-heptyl-N-octyl-3-methyl-.
Sources
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