Basic information
- CAS
92177-52-1- Standard SMILES
CCC=CCC=CCC=CCCCCCCCC(=O)OCC- InChIKey
JYYFMIOPGOFNPK-UHFFFAOYSA-N- Molecular formula
- C20H34O2
- Average molar mass
- 306.5 g/mol
- Monoisotopic mass
- 306.25588032
Overview
Ethyl octadeca-9,12,15-trienoate has been reported in Mangifera indica and Bidens pilosa with data available.
Names & identifiers
- Preferred name
- Ethyl octadeca-9,12,15-trienoate
- IUPAC
- ethyl octadeca-9,12,15-trienoate
- English name
- Ethyl linolenate
- Molecular weight
- 0
Names & synonyms
ethyl octadeca-9,12,15-trienoate92177-52-1DTXSID20859597RefChem:139023DTXCID50809782Ethyl octadeca-9,12,15-trienoic acidEthyl linolenic acidEthyl linolenoate; Ethyl alpha-linolenate9,12,15-Octadecatrienoic acid ethyl esterSCHEMBL4814473ETHYL LINOLENATE, 80-85%NCI60_004708
Show more names
9,12,15-octadecatrienoic acid-ethyl esterDB-041446
Database identifiers
- CAS
92177-52-1- PubChem CID
- 79149
- DTXSID
DTXSID20859597
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 15
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 327
Experimental & physicochemical properties
Flavoring AgentsEU Flavoring substances
Chemistry & industry
Suppliers1 total
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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