이름: [3-chloro-4-(cyclopropylcarbamoyl)phenyl]boronic acid
SMILES:
O=C(NC1CC1)c1ccc(B(O)O)cc1ClMolecular Processing
Molecular formula
C10H11BClNO3
Molecular weight
239.47
Exact mass
239.0521
XLogP
-0.09
TPSA
69.56
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
61.77
Supplementary Information
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