1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 5KUF22WH2H

Structure

InChI Key KASJZXHXXNEULX-UHFFFAOYSA-N
Smiles O=C1CCCc2[nH]ccc12
InChI
InChI=1S/C8H9NO/c10-8-3-1-2-7-6(8)4-5-9-7/h4-5,9H,1-3H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H9N1O1
Molecular Weight 135.07
AlogP 1.53
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Polar Surface Area 32.86
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 13754-86-4
NORMAN SUSDAT
FDA SRS 5KUF22WH2H
CONTENTS