QUINOLINE, 1,2,3,4-TETRAHYDRO-4-METHYL-

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII PCF8IC3A94
EPA CompTox DTXSID40864885

Structure

InChI Key OXNZWCYNCDWCJA-UHFFFAOYSA-N
Smiles CC1CCNc2ccccc12
InChI
InChI=1S/C10H13N/c1-8-6-7-11-10-5-3-2-4-9(8)10/h2-5,8,11H,6-7H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H13N1
Molecular Weight 147.1
AlogP 2.61
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Polar Surface Area 12.03
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 19343-78-3
NORMAN SUSDAT
FDA SRS PCF8IC3A94
PubChem 86854
ChemSpider 78351.0
CONTENTS