SMILES:
Cn1c(B(O)O)cc2ccc(Cl)cc21Molecular Processing
Molecular formula
C9H9BClNO2
Molecular weight
209.44
Exact mass
209.0415
XLogP
0.51
TPSA
45.39
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
57.75
Supplementary Information
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