4-Bromo-2-cyclohexen-1-one
Basic information
- CAS
54664-62-9- Standard SMILES
O=C1C=CC(Br)CC1- InChIKey
IWGYWIYLDDQZBU-UHFFFAOYSA-N- Molecular formula
- C6H7BrO
- Average molar mass
- 175.02 g/mol
- Monoisotopic mass
- 173.96803
Names & identifiers
- Preferred name
- 4-Bromo-2-cyclohexen-1-one
- IUPAC
- 4-bromocyclohex-2-en-1-one
Names & synonyms
4-Bromo-2-cyclohexen-1-one54664-62-9RefChem:2907014-bromocyclohexenone4-bromocyclohex-2-en-1-oneDTXSID201311642
Database identifiers
- CAS
54664-62-9- PubChem CID
- 11041222
- DTXSID
DTXSID201311642
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 128
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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