2-Benzyl-2-bromo-4,4-dimethyl-3,4-dihydro-1(2H)-naphthalenone
Basic information
- CAS
17408-11-6- Standard SMILES
CC1(C)CC(Br)(Cc2ccccc2)C(=O)c2ccccc21- InChIKey
RQUFVADUAKLTFG-UHFFFAOYSA-N- Molecular formula
- C19H19BrO
- Average molar mass
- 343.3 g/mol
- Monoisotopic mass
- 342.06193
Names & identifiers
- Preferred name
- 2-Benzyl-2-bromo-4,4-dimethyl-3,4-dihydro-1(2H)-naphthalenone
- IUPAC
- 2-benzyl-2-bromo-4,4-dimethyl-3H-naphthalen-1-one
Names & synonyms
17408-11-62-Benzyl-2-bromo-4,4-dimethyl-3,4-dihydro-1(2H)-naphthalenoneNSC150116NSC 150116NSC-1501162-benzyl-2-bromo-4,4-dimethyl-tetralin-1-one
Database identifiers
- CAS
17408-11-6- PubChem CID
- 288776
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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