Keyword(s): Human Metabolites
Molecule Category Free-form
UNII I381XEH64W

Structure

InChI Key KGFRUGHBHNUHOS-UHFFFAOYSA-N
Smiles C[Pb](CC)(CC)CC
InChI
InChI=1/3C2H5.CH3.Pb/c3*1-2;;/h3*1H2,2H3;1H3;/rC7H18Pb/c1-5-8(4,6-2)7-3/h5-7H2,1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C7H18Pb
Molecular Weight 310.12
AlogP 3.12
Number of Rotational Bond 3.0
Heavy Atoms 8.0

Cross References

Resources Reference
CAS NUMBER 1762-28-3
NORMAN SUSDAT
FDA SRS I381XEH64W