이름: 3-methyl-phenyl-boric acid
SMILES:
Cc1cccc(OB(O)O)c1Molecular Processing
Molecular formula
C7H9BO3
Molecular weight
151.96
Exact mass
152.0645
XLogP
0.34
TPSA
49.69
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
42
Supplementary Information
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