1-(4-Bromophenyl)-2-(3,4-dihydroquinolin-1(2H)-yl)ethan-1-one
Basic information
- CAS
6320-93-0- Standard SMILES
O=C(CN1CCCc2ccccc21)c1ccc(Br)cc1- InChIKey
ZQNJAZLWNFIUOP-UHFFFAOYSA-N- Molecular formula
- C17H16BrNO
- Average molar mass
- 330.2 g/mol
- Monoisotopic mass
- 329.04153
Names & identifiers
- Preferred name
- 1-(4-Bromophenyl)-2-(3,4-dihydroquinolin-1(2H)-yl)ethan-1-one
- IUPAC
- 1-(4-bromophenyl)-2-(3,4-dihydro-2H-quinolin-1-yl)ethanone
Names & synonyms
6320-93-0NSC32248DTXSID40283592NSC-32248AKOS0089684371-(4-Bromophenyl)-2-(3,4-dihydroquinolin-1(2H)-yl)ethan-1-one
Database identifiers
- CAS
6320-93-0- PubChem CID
- 233585
- DTXSID
DTXSID40283592
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…