7-Bromo-2-methylcyclohepta[b]furan-8-one
Basic information
- CAS
50904-33-1- Standard SMILES
Cc1cc2cccc(Br)c(=O)c2o1- InChIKey
RDXFNCODLIWZIY-UHFFFAOYSA-N- Molecular formula
- C10H7BrO2
- Average molar mass
- 239.06 g/mol
- Monoisotopic mass
- 237.96294
Names & identifiers
- Preferred name
- 7-Bromo-2-methylcyclohepta[b]furan-8-one
- IUPAC
- 7-bromo-2-methylcyclohepta[b]furan-8-one
Names & synonyms
50904-33-17-bromo-2-methylcyclohepta[b]furan-8-oneNSC301765DTXSID70316307NSC-3017657-Bromo-2-methyl-8H-cyclohepta[b]furan-8-one
Database identifiers
- CAS
50904-33-1- PubChem CID
- 327307
- DTXSID
DTXSID70316307
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 293
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Compound notes
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