- InChI
- InChI=1S/C26H49NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-30-26(29)20-21-27-25(28)23-24(2)3/h23H,4-22H2,1-3H3,(H,27,28)
- InChI Key
- CKIGYGSVBKQUHL-UHFFFAOYSA-N
- Formula
- C26H49NO3
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)CCN=C(
O)C=C(C)C - Molecular Weight1
- 423.67
- 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).
- 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 | -797.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.74 | kJ/mol | Joback Calculated Property |
| log10WS | -8.41 | Crippen Calculated Property | |
| logPoct/wat | 8.104 | Crippen Calculated Property | |
| McVol | 391.890 | ml/mol | McGowan Calculated Property |
| Pc | 763.52 | kPa | Joback Calculated Property |
| Tboil | 1043.35 | K | Joback Calculated Property |
| Tc | 1296.42 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to «beta»-Alanine, N-(3-methylbut-2-enoyl)-, octadecyl ester.
Sources
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