名称: 1-benzyl-4-methyl-piperidin-3-one
SMILES:
CC1CCN(Cc2ccccc2)CC1=OMolecular Processing
Molecular formula
C13H17NO
Molecular weight
203.28
Exact mass
203.131
XLogP
2.1
TPSA
20.31
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
60.51
Supplementary Information
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