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

Structure

InChI Key AMYVJTAMFWGYHI-UHFFFAOYSA-N
Smiles [Li]C1c2ccccc2c3ccccc13
InChI
InChI=1/C13H9.Li/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;/h1-9H;/rC13H9Li/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8,13H

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H9Li
Molecular Weight 172.09
AlogP 2.92
Heavy Atoms 14.0

Cross References

Resources Reference
CAS NUMBER 881-04-9
NORMAN SUSDAT