Basic information
- CAS
6319-09-1- Standard SMILES
BrC1CC2CC1C1COCC21- InChIKey
MOBCGDJENPQGNG-UHFFFAOYSA-N- Molecular formula
- C9H13BrO
- Average molar mass
- 217.1 g/mol
- Monoisotopic mass
- 216.01498
Names & identifiers
- Preferred name
- 5-Bromooctahydro-4,7-methano-2-benzofuran
- IUPAC
- 8-bromo-4-oxatricyclo[5.2.1.02,6]decane
Names & synonyms
6319-09-15-bromooctahydro-4,7-methano-2-benzofuranNSC31981DTXSID00283533NSC-31981
Database identifiers
- CAS
6319-09-1- PubChem CID
- 233455
- DTXSID
DTXSID00283533
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 182
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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