이름: 2-(4-Fluoro-phenyl)-cyclohexanone
SMILES:
O=C1CCCCC1c1ccc(F)cc1Molecular Processing
Molecular formula
C12H13FO
Molecular weight
192.23
Exact mass
192.095
XLogP
3.05
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
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
0.417
Molar refractivity
52.62
Supplementary Information
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