SMILES:
COc1ccc(B(O)O)cc1Cc1ccccc1Molecular Processing
Molecular formula
C14H15BO3
Molecular weight
242.08
Exact mass
242.1114
XLogP
0.97
TPSA
49.69
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
2
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
72.07
Supplementary Information
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