Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key GQBRIYIRPORZOM-UHFFFAOYSA-M
Smiles [Br]|[Sn](CCC)(CCC)CCC
InChI
InChI=1S/3C3H7.BrH.Sn/c3*1-3-2;;/h3*1,3H2,2H3;1H;/q;;;;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H21Br1Sn1
Molecular Weight 327.98
AlogP 0.31
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 2767-61-5
NORMAN SUSDAT