SpiceCom: A database of phytochemicals in major spices

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OCTAN-2-ONE

PubChem ID
8093
Chemical Name
OCTAN-2-ONE
Molecular Formula
C8H16O
Canonical SMILES
CCCCCCC(=O)C
IUPAC Name
octan-2-one
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Molecular Weight
128.215 g/mol
XLogP
2.4
Rotatable Bond Count
5
Lipinsky's Rule of Five
Yes
Sources
Clove
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