2-Bromo-4,4-dimethyl-2-(2-methylbenzyl)-3,4-dihydro-1(2H)-naphthalenone
Basic information
- CAS
30765-56-1- Standard SMILES
Cc1ccccc1CC1(Br)CC(C)(C)c2ccccc2C1=O- InChIKey
QUILCJBMGKHGDA-UHFFFAOYSA-N- Molecular formula
- C20H21BrO
- Average molar mass
- 357.3 g/mol
- Monoisotopic mass
- 356.07758
Names & identifiers
- Preferred name
- 2-Bromo-4,4-dimethyl-2-(2-methylbenzyl)-3,4-dihydro-1(2H)-naphthalenone
- IUPAC
- 2-bromo-4,4-dimethyl-2-[(2-methylphenyl)methyl]-3H-naphthalen-1-one
Names & synonyms
30765-56-12-Bromo-4,4-dimethyl-2-(2-methylbenzyl)-3,4-dihydro-1(2H)-naphthalenoneNSC150336NSC 150336NSC-1503362-bromo-4,4-dimethyl-2-(o-tolylmethyl)tetralin-1-one
Database identifiers
- CAS
30765-56-1- PubChem CID
- 288958
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 429
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…