名称: 2-(2-oxocyclohexyl)acetophenone
SMILES:
O=C(CC1CCCCC1=O)c1ccccc1Molecular Processing
Molecular formula
C14H16O2
Molecular weight
216.28
Exact mass
216.115
XLogP
3.02
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
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
0.429
Molar refractivity
62.35
Supplementary Information
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