1(2H)-NAPHTHALENONE, 3,4-DIHYDRO-8-METHYL-

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII D9W56OZV5G
EPA CompTox DTXSID5068607

Structure

InChI Key ACEWUDFEONXYQH-UHFFFAOYSA-N
Smiles Cc1cccc2CCCC(=O)c12
InChI
InChI=1S/C11H12O/c1-8-4-2-5-9-6-3-7-10(12)11(8)9/h2,4-5H,3,6-7H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H12O1
Molecular Weight 160.09
AlogP 2.51
Hydrogen Bond Acceptor 1.0
Polar Surface Area 17.07
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 51015-28-2
NORMAN SUSDAT
FDA SRS D9W56OZV5G
PubChem 162619
ChemSpider 142772.0
CONTENTS