Basic information
- CAS
6990-17-6- Standard SMILES
CC(C)=C1CC/C(C)=C\C/C=C(\C)CC1=O- InChIKey
VFQUTODDWOXXJK-VOFKWTQNSA-N- Molecular formula
- C15H22O
- Average molar mass
- 218.33 g/mol
- Monoisotopic mass
- 218.16706532
Names & identifiers
- Preferred name
- 3,7-Dimethyl-10-(1-methylethylidene)-3,6-cyclodecadien-1-one
- IUPAC
- (3E,6Z)-3,7-dimethyl-10-propan-2-ylidenecyclodeca-3,6-dien-1-one
Names & synonyms
DTXSID7011862843,7-Dimethyl-10-(1-methylethylidene)-3,6-cyclodecadien-1-one(3E,6Z)-3,7-Dimethyl-10-(propan-2-ylidene)cyclodeca-3,6-dien-1-one6990-17-6
Database identifiers
- CAS
6990-17-6- PubChem CID
- 165353003
- DTXSID
DTXSID701186284
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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