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ISOBUTYL-ISOVALERATE
PubChem ID
11514
Chemical Name
ISOBUTYL-ISOVALERATE
Molecular Formula
C
9
H
18
O
2
Canonical SMILES
CC(C)CC(=O)OCC(C)C
IUPAC Name
2-methylpropyl 3-methylbutanoate
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Molecular Weight
158.241 g/mol
XLogP
2.7
Rotatable Bond Count
5
Lipinsky's Rule of Five
Yes
Sources
Black pepper
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3D SDF
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