Basic information
- Standard SMILES
CCCN1C(=O)CC(C)(C)c2cc(C)c(Br)cc21- InChIKey
QBRKQYMAWUFRDT-UHFFFAOYSA-N- Molecular formula
- C15H20BrNO
- Average molar mass
- 310.23 g/mol
Names & identifiers
- Preferred name
- 7-bromo-1-propyl-4,4,6-trimethyl-3,4-dihydro-1H-quinoline-2-one
- IUPAC
- 7-bromo-4,4,6-trimethyl-1-propyl-3H-quinolin-2-one
Names & synonyms
SCHEMBL3497772QBRKQYMAWUFRDT-UHFFFAOYSA-N7-bromo-1-propyl-4,4,6-trimethyl-3,4-dihydro-1H-quinoline-2-one
Database identifiers
- PubChem CID
- 21966426
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 328
Related reactions
2 records
Compound notes
Loading…