1H-BENZIMIDAZOLE, 1-METHYL-

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 12LW89N19Y
EPA CompTox DTXSID90167530

Structure

InChI Key FGYADSCZTQOAFK-UHFFFAOYSA-N
Smiles Cn1cnc2ccccc12
InChI
InChI=1S/C8H8N2/c1-10-6-9-7-4-2-3-5-8(7)10/h2-6H,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H8N2
Molecular Weight 132.07
AlogP 1.57
Hydrogen Bond Acceptor 2.0
Polar Surface Area 17.82
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 1632-83-3
NORMAN SUSDAT
FDA SRS 12LW89N19Y
PubChem 95890
ChemSpider 86565.0
CONTENTS