methyl (3E,5E,7E,9E,11E)-tetradeca-3,5,7,9,11,13-hexaenoate
Basic information
- CAS
68604-39-7- Standard SMILES
C=C/C=C/C=C/C=C/C=C/C=C/CC(=O)OC- InChIKey
AGHWLRVHEXUTPZ-ISFAVVKVSA-N- Molecular formula
- C15H18O2
- Average molar mass
- 230.3 g/mol
- Monoisotopic mass
- 230.13067981
Names & identifiers
- Preferred name
- methyl (3E,5E,7E,9E,11E)-tetradeca-3,5,7,9,11,13-hexaenoate
- IUPAC
- methyl (3E,5E,7E,9E,11E)-tetradeca-3,5,7,9,11,13-hexaenoate
Names & synonyms
AGHWLRVHEXUTPZ-ISFAVVKVSA-N
Database identifiers
- CAS
68604-39-7- PubChem CID
- 6437574
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 355
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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