Basic information
- CAS
521917-66-8- Standard SMILES
COc1ccc2c(c1)C=C(Br)CC2- InChIKey
JJRLJTJZVTWBQX-UHFFFAOYSA-N- Molecular formula
- C11H11BrO
- Average molar mass
- 239.11 g/mol
- Monoisotopic mass
- 237.99933
Names & identifiers
- Preferred name
- 3-Bromo-6-methoxy-1,2-dihydronaphthalene
- IUPAC
- 3-bromo-6-methoxy-1,2-dihydronaphthalene
- English name
- 3-Bromo-6-methoxy-1,2-dihydronaphthalene
- Molecular formula
- C11H11BrO
- Molecular weight
- 239.11
Names & synonyms
521917-66-83-bromo-6-methoxy-1,2-dihydronaphthaleneSCHEMBL5779686DTXSID20470509DB-099138Naphthalene, 3-bromo-1,2-dihydro-6-methoxy-
Database identifiers
- CAS
521917-66-8- PubChem CID
- 11680291
- DTXSID
DTXSID20470509
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 212
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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