- InChI
- InChI=1S/C21H38O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h6-7,9-10,12-13H,5,8,11,14-20H2,1-4H3/b7-6-,10-9-,13-12-
- InChI Key
- DCFAEXKJEMZTKR-QNEBEIHSSA-N
- Formula
- C21H38O2Si
- SMILES
-
CCC=CCC=CCC=CCCCCCCCC(=O)O[Si]
(C)(C)C - Molecular Weight1
- 350.61
- CAS
- 97844-13-8
- Other Names
-
- Trimethylsilyl (3Z,6Z,9Z)-3,6,9-octadecatrienoate
- «alpha»-Linolenic acid, TMS
- cis,cis,cis-9,12,15-Octadecatrienoic acid, trimethylsilyl ester
- Trimethylsilyl linolenate
- «ALPHA»-linolenic acid, tms derivative
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- Inp : Non-polar retention indices.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| log10WS | -5.09 | Crippen Calculated Property | |
| logPoct/wat | 6.954 | Crippen Calculated Property | |
| Inp | [2218.00; 2218.70] |
|
|
| Inp | 2218.00 | NIST | |
| Inp | 2218.70 | NIST | |
| Inp | 2218.00 | NIST |
Similar Compounds
Find more compounds similar to «alpha»-Linolenic acid, trimethylsilyl ester.
Sources
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