- InChI
- InChI=1S/C27H55NO2/c1-3-5-7-9-11-13-14-15-16-17-18-19-21-23-25-28-27(29)30-26-24-22-20-12-10-8-6-4-2/h3-26H2,1-2H3,(H,28,29)
- InChI Key
- HULDRIDDDNECTJ-UHFFFAOYSA-N
- Formula
- C27H55NO2
- SMILES
-
CCCCCCCCCCCCCCCCN=C(O)OCCCCCCC
CCC - Molecular Weight1
- 425.73
- 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 | 1.4355 | Relay (1.0) Calculated Property | |
| ΔfG° | 15.02 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -920.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 152.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.74 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.85 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.539 | Crippen Calculated Property | |
| McVol | 408.710 | ml/mol | McGowan Calculated Property |
| Pc | 679.94 | kPa | Joback Calculated Property |
| Inp | [1565.00; 1565.00] |
|
|
| Inp | 1565.00 | NIST | |
| Inp | 1565.00 | NIST | |
| Tboil | 659.66 | K | Relay (1.0) Calculated Property |
| Tc | 858.96 | K | Relay (1.0) Calculated Property |
| Tfus | 354.58 | K | Relay (1.0) Calculated Property |
| Vc | 1.586 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, monoamide, N-hexadecyl-, decyl ester.
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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