- InChI
- InChI=1S/C20H37NO5/c1-4-6-8-10-12-14-18(22)21-17(20(24)25-3)16-26-19(23)15-13-11-9-7-5-2/h17H,4-16H2,1-3H3,(H,21,22)
- InChI Key
- DXUOHGDEBRLPEU-UHFFFAOYSA-N
- Formula
- C20H37NO5
- SMILES
-
CCCCCCCC(=O)OCC(N=C(O)CCCCCCC)
C(=O)OC - Molecular Weight1
- 371.51
- 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 | 1.1577 | Relay (1.0) Calculated Property | |
| ΔfG° | -398.82 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1170.63 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 129.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.92 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.50 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.749 | Crippen Calculated Property | |
| McVol | 319.090 | ml/mol | McGowan Calculated Property |
| Pc | 1077.81 | kPa | Joback Calculated Property |
| Inp | [2544.00; 2544.00] |
|
|
| Inp | 2544.00 | NIST | |
| Inp | 2544.00 | NIST | |
| Tboil | 640.18 | K | Relay (1.0) Calculated Property |
| Tc | 825.61 | K | Relay (1.0) Calculated Property |
| Tfus | 344.34 | K | Relay (1.0) Calculated Property |
| Vc | 1.184 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to l-Serine, N,O-bis(capryloyl)-, methyl 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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