Basic information
- CAS
88354-63-6- Standard SMILES
C=C(C)C=CC(=O)C(C)(C)CC(OC(C)=O)C(=O)CC- InChIKey
SEXYHMXVPDBWMR-UHFFFAOYSA-N- Molecular formula
- C16H24O4
- Average molar mass
- 280.36 g/mol
- Monoisotopic mass
- 280.16745924
Names & identifiers
- Preferred name
- 8,10-Undecadiene-3,7-dione, 4-(acetyloxy)-6,6,10-trimethyl-, (E)-
- IUPAC
- (6,6,10-trimethyl-3,7-dioxoundeca-8,10-dien-4-yl) acetate
Names & synonyms
DTXSID703405018,10-Undecadiene-3,7-dione, 4-(acetyloxy)-6,6,10-trimethyl-, (E)-88354-63-6RefChem:311527DTXCID502915826,6,10-TRIMETHYL-3,7-DIOXOUNDECA-8,10-DIEN-4-YL ACETATE
Database identifiers
- CAS
88354-63-6- PubChem CID
- 565299
- DTXSID
DTXSID70340501
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 430
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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