1-METHYL-4-PIPERIDONE

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII W923NR2QCS
EPA CompTox DTXSID20162735

Structure

InChI Key HUUPVABNAQUEJW-UHFFFAOYSA-N
Smiles CN1CCC(=O)CC1
InChI
InChI=1S/C6H11NO/c1-7-4-2-6(8)3-5-7/h2-5H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H11N1O1
Molecular Weight 113.08
AlogP 0.28
Hydrogen Bond Acceptor 2.0
Polar Surface Area 20.31
Heavy Atoms 8.0

Cross References

Resources Reference
CAS NUMBER 1445-73-4
NORMAN SUSDAT
FDA SRS W923NR2QCS
PubChem 74049
ChemSpider 66668.0
CONTENTS