Keyword(s): Human Metabolites
Molecule Category Free-form
UNII B2PDN2XO5U
EPA CompTox DTXSID4024775

Structure

InChI Key IBYHHJPAARCAIE-UHFFFAOYSA-N
Smiles ClCCBr
InChI
InChI=1S/C2H4BrCl/c3-1-2-4/h1-2H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H4Br1Cl1
Molecular Weight 141.92
AlogP 1.62
Number of Rotational Bond 1.0
Heavy Atoms 4.0

Cross References

Resources Reference
CAS NUMBER 107-04-0
NORMAN SUSDAT
FDA SRS B2PDN2XO5U
PubChem 7849
ChemSpider 13854130.0