SMILES:
COc1cccc(B(O)O)c1OCMolecular Processing
Molecular formula
C8H11BO4
Molecular weight
181.98
Exact mass
182.075
XLogP
-0.62
TPSA
58.92
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
13
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
0.25
Molar refractivity
49.37
Supplementary Information
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