QUINOLINE, 6-BROMO-

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII KS7HD5UJ94
EPA CompTox DTXSID5063788

Structure

InChI Key IFIHYLCUKYCKRH-UHFFFAOYSA-N
Smiles Brc1cc2cccnc2cc1
InChI
InChI=1S/C9H6BrN/c10-8-3-4-9-7(6-8)2-1-5-11-9/h1-6H

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H6Br1N1
Molecular Weight 206.97
AlogP 3.0
Hydrogen Bond Acceptor 1.0
Polar Surface Area 12.89
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 5332-25-2
NORMAN SUSDAT
FDA SRS KS7HD5UJ94
PubChem 79243
ChemSpider 71568.0
CONTENTS