Basic information
- Standard SMILES
CCCCC/C=C\CCC/C=C/CCOC(C)=O- InChIKey
WWXVCCMNRBSSKV-LQZWXTFHSA-N- Molecular formula
- C16H28O2
- Average molar mass
- 252.39 g/mol
- Monoisotopic mass
- 252.20893014
Overview
3E,8Z-Tetradecadienyl acetate is a carboxylic ester.
Names & identifiers
- Preferred name
- 3E,8Z-Tetradecadienyl acetate
- IUPAC
- [(3E,8Z)-tetradeca-3,8-dienyl] acetate
Names & synonyms
3E,8Z-Tetradecadienyl acetateRefChem:1068902[(3E,8Z)-tetradeca-3,8-dienyl] acetate(3E,8Z)-TETRADECA-3,8-DIEN-1-YL ACETATE3,8-Tetradecadien-1-ol, acetate, (3E,8Z)- (9CI)(3E,8Z)-3,8-tetradecadienyl acetate3E8Z-14AcMFCD28124347(3E,8Z)-3,8-tetradecadien-1-yl acetate3E,8Z-Tetradecadienyl Acetate (>85%)(E,Z)-3,8-Tetradecadienyl Acetate; trans-3,cis-8-Tetradecadienyl Acetate; (E,Z)-3,8-Tetradecadien-1-ol Acetate; (3E,8Z)-3,8-Tetradecadien-1-ol Acetate; (3E,8Z)-3,8-Tetradecadien-1-ol 1-Acetate;orb2563899
Show more names
SCHEMBL1301284E3, Z8-tetradecadienyl acetateCHEBI:196071WWXVCCMNRBSSKV-LQZWXTFHSA-NDTXSID501376685LMFA07010301TN7927trans-3,cis-8-Tetradecadienyl acetate
Database identifiers
- CAS
163041-87-0- PubChem CID
- 10538786
- DTXSID
DTXSID501376685- ChEBI
CHEBI:196071- Nikkaji
- J699.699J
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 241
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty esters [FA07] -> Short fatty esters [FA0710]
Related reactions
2 records
Linked notes
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