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SAFROLE
PubChem ID
5144
Chemical Name
SAFROLE
Molecular Formula
C
10
H
10
O
2
Canonical SMILES
C=CCC1=CC2=C(C=C1)OCO2
IUPAC Name
5-prop-2-enyl-1,3-benzodioxole
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Molecular Weight
162.188 g/mol
XLogP
3
Rotatable Bond Count
2
Lipinsky's Rule of Five
Yes
Sources
Black pepper, Cinnamon, Nutmeg
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3D SDF
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