SMILES:
CCCc1ccccc1B(O)OMolecular Processing
Molecular formula
C9H13BO2
Molecular weight
164.01
Exact mass
164.1009
XLogP
0.32
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
50.26
Supplementary Information
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