Basic information
- CAS
138146-05-1- Standard SMILES
C=CC(=O)C1C/C=C\C=C/CC1- InChIKey
ORMHBBDFFACMFY-GLIMQPGKSA-N- Molecular formula
- C11H14O
- Average molar mass
- 162.23 g/mol
- Monoisotopic mass
- 162.10446507
Names & identifiers
- Preferred name
- 2-Propen-1-one, 1-(1,3-cyclooctadien-6-yl)-, (Z,Z)-
- IUPAC
- 1-[(3Z,5Z)-cycloocta-3,5-dien-1-yl]prop-2-en-1-one
Names & synonyms
6-(1'-Oxo-2'-propenyl)-1,3-cis,cis-cyclooctadiene1-[(3Z,5Z)-cycloocta-3,5-dien-1-yl]prop-2-en-1-one2-Propen-1-one, 1-(1,3-cyclooctadien-6-yl)-, (Z,Z)-ORMHBBDFFACMFY-GLIMQPGKSA-NDTXSID901016308138146-05-11-(3,5-Cyclooctadien-1-yl)-2-propen-1-one #6-(1-Oxo-2-propenyl)-1,3-cis,cis-cyclooctadiene
Database identifiers
- CAS
138146-05-1- PubChem CID
- 5367356
- DTXSID
DTXSID901016308
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 223
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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