Basic information
- CAS
7500-27-8- Standard SMILES
CC(Br)C(=O)C(c1ccccc1)(c1ccccc1)C(C)CN(C)C- InChIKey
FQENEZQJHZAKPK-UHFFFAOYSA-N- Molecular formula
- C21H26BrNO
- Average molar mass
- 388.3 g/mol
- Monoisotopic mass
- 387.11978
Names & identifiers
- Preferred name
- 2-Bromo-6-(dimethylamino)-5-methyl-4,4-diphenylhexan-3-one
- IUPAC
- 2-bromo-6-(dimethylamino)-5-methyl-4,4-diphenylhexan-3-one
Names & synonyms
7500-27-8NSC4004302-bromo-6-(dimethylamino)-5-methyl-4,4-diphenylhexan-3-oneDTXSID60331185NSC-400430DS-0130172-bromo-6-dimethylamino-5-methyl-4,4-diphenyl-hexan-3-one
Database identifiers
- CAS
7500-27-8- PubChem CID
- 436201
- DTXSID
DTXSID60331185
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 379
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…