Basic information
- CAS
247174-19-2- Standard SMILES
COc1ccc2cc(Br)ccc2c1OC=O- InChIKey
XPMVIUZRQZZOQV-UHFFFAOYSA-N- Molecular formula
- C12H9BrO3
- Average molar mass
- 281.1 g/mol
- Monoisotopic mass
- 279.97351
Names & identifiers
- Preferred name
- 1-Naphthalenol, 6-bromo-2-methoxy-, 1-formate
- IUPAC
- (6-bromo-2-methoxynaphthalen-1-yl) formate
Names & synonyms
247174-19-21-Naphthalenol, 6-bromo-2-methoxy-, 1-formateSCHEMBL5752075DTXSID8012522246-Bromo-2-methoxynaphthalen-1-yl formate
Database identifiers
- CAS
247174-19-2- PubChem CID
- 22018359
- DTXSID
DTXSID801252224
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 246
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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