Name: 2-(4-pyridyl)-1-(4-chlorophenyl)ethanone
SMILES:
O=C(Cc1ccncc1)c1ccc(Cl)cc1Molecular Processing
Molecular formula
C13H10ClNO
Molecular weight
231.68
Exact mass
231.0451
XLogP
3.16
TPSA
29.96
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
63.72
Supplementary Information
Details werden geladen…
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