Keyword(s): Human Metabolites
Molecule Category Free-form
UNII O18V5XYO0G
EPA CompTox DTXSID5060140

Structure

InChI Key FXXACINHVKSMDR-UHFFFAOYSA-N
Smiles CC(Br)=O
InChI
InChI=1S/C2H3BrO/c1-2(3)4/h1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H3Br1O1
Molecular Weight 121.94
AlogP 0.93
Hydrogen Bond Acceptor 1.0
Polar Surface Area 17.07
Heavy Atoms 4.0

Cross References

Resources Reference
CAS NUMBER 506-96-7
NORMAN SUSDAT
FDA SRS O18V5XYO0G
PubChem 10482
ChemSpider 10050.0