Cc1ccccc1.OB(O)O
Name: 4-Methylbenzeneboric acid
SMILES: Cc1ccccc1.OB(O)O

Molecular Processing

Molecular formula
C7H11BO3
Molecular weight
153.97
Exact mass
154.0801
XLogP
-0.06
TPSA
60.69
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
0
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
2
Fraction Csp3
0.143
Molar refractivity
43.59

Supplementary Information

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