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Basic information
- Standard SMILES
O=C1CCCc2c(O)cc(Br)cc21- InChIKey
KRHXXJLNCUMLJG-UHFFFAOYSA-N- Molecular formula
- C10H9BrO2
- Average molar mass
- 241.08 g/mol
Names & identifiers
- Preferred name
- 7-bromo-5-hydroxy-3,4-dihydro-2H-naphthalen-1-one
- IUPAC
- 7-bromo-5-hydroxy-3,4-dihydro-2H-naphthalen-1-one
Names & synonyms
7-bromo-5-hydroxy-3,4-dihydro-2H-naphthalen-1-oneSCHEMBL3205385KRHXXJLNCUMLJG-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 59192523
Properties
Computed structural propertiesFilling in
- XLogP
- 2.4
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 217
Related reactions
4 records
Compound notes
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