Name: 4-cyanophenylboric acid
SMILES:
N#Cc1ccc(OB(O)O)cc1Molecular Processing
Molecular formula
C7H6BNO3
Molecular weight
162.94
Exact mass
163.0441
XLogP
-0.09
TPSA
73.48
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
41.98
Supplementary Information
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