Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 57F9KU116M

Structure

InChI Key LVKZSFMYNWRPJX-UHFFFAOYSA-N
Smiles O[As](=O)(O)c1ccccc1
InChI
InChI=1/C6H7AsO3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H,(H2,8,9,10)

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H7AsO3
Molecular Weight 201.96
AlogP -0.75
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 57.53
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 98-05-5
NORMAN SUSDAT
FDA SRS 57F9KU116M