이름: 2-(hydroxymethyl)benzeneboronic acid cyclic monoester
SMILES:
OB1OCc2ccccc21Molecular Processing
Molecular formula
C7H7BO2
Molecular weight
133.94
Exact mass
134.0539
XLogP
-0.1
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
10
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
38.84
Supplementary Information
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