Name: 2-chloro-5-(4-acetylphenyl)pyridine
SMILES:
CC(=O)c1ccc(-c2ccc(Cl)nc2)cc1Molecular Processing
Molecular formula
C13H10ClNO
Molecular weight
231.68
Exact mass
231.0451
XLogP
3.6
TPSA
29.96
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
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
64.69
Supplementary Information
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