Name: 3-acetyl-4-fluorophenylboronic acid
SMILES:
CC(=O)c1cc(B(O)O)ccc1FMolecular Processing
Molecular formula
C8H8BFO3
Molecular weight
181.96
Exact mass
182.0551
XLogP
-0.29
TPSA
57.53
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
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
0.125
Molar refractivity
46.23
Supplementary Information
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