- InChI
- InChI=1S/C28H53NO4/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-22-24-32-27(30)26(23-6-3)29-28(31)33-25-21-10-8-5-2/h6,26H,3-5,7-25H2,1-2H3,(H,29,31)
- InChI Key
- HVBMGFXPIOJPHN-UHFFFAOYSA-N
- Formula
- C28H53NO4
- SMILES
-
C=CCC(N=C(O)OCCCCCC)C(=O)OCCCC
CCCCCCCCCCCC - Molecular Weight1
- 467.72
- ΔfH°gas : Enthalpy of formation 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -957.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.50 | kJ/mol | Joback Calculated Property |
| log10WS | -8.94 | Crippen Calculated Property | |
| logPoct/wat | 8.466 | Crippen Calculated Property | |
| McVol | 425.940 | ml/mol | McGowan Calculated Property |
| Pc | 679.94 | kPa | Joback Calculated Property |
| Inp | [3135.00; 3135.00] |
|
|
| Inp | 3135.00 | NIST | |
| Inp | 3135.00 | NIST | |
| Tboil | 1103.73 | K | Joback Calculated Property |
| Tc | 1398.51 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Aminopent-4-enoic acid, N-hexyloxycarbonyl-, hexadecyl ester.
Sources
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