Keyword(s): Human Metabolites
Molecule Category Free-form
UNII MN8EZ3FL74

Structure

InChI Key BPLUKJNHPBNVQL-UHFFFAOYSA-N
Smiles c1ccc(cc1)[As](c2ccccc2)c3ccccc3
InChI
InChI=1/C18H15As/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H15As
Molecular Weight 306.04
AlogP 2.2
Number of Rotational Bond 3.0
Heavy Atoms 19.0

Cross References

Resources Reference
CAS NUMBER 603-32-7
NORMAN SUSDAT
FDA SRS MN8EZ3FL74