- InChI
- InChI=1S/C20H41NO/c1-4-7-9-10-11-12-13-14-15-17-20(22)21-18-19(6-3)16-8-5-2/h19H,4-18H2,1-3H3,(H,21,22)
- InChI Key
- MNVHKIUZEBEPKA-UHFFFAOYSA-N
- Formula
- C20H41NO
- SMILES
- CCCCCCCCCCCC(O)=NCC(CC)CCCC
- Molecular Weight1
- 311.55
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 1.0603 | Relay (1.0) Calculated Property | |
| ΔfG° | 46.47 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -613.20 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 121.79 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.97 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.49 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.080 | Crippen Calculated Property | |
| McVol | 304.210 | ml/mol | McGowan Calculated Property |
| Pc | 1015.53 | kPa | Joback Calculated Property |
| Inp | [2365.00; 2365.00] |
|
|
| Inp | 2365.00 | NIST | |
| Inp | 2365.00 | NIST | |
| Tboil | 625.92 | K | Relay (1.0) Calculated Property |
| Tc | 812.33 | K | Relay (1.0) Calculated Property |
| Tfus | 328.43 | K | Relay (1.0) Calculated Property |
| Vc | 1.129 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Dodecanamide, N-2-ethylhexyl-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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