SMILES:
CC(=O)Nc1ccc(B(O)O)cc1Molecular Processing
Molecular formula
C8H10BNO3
Molecular weight
178.98
Exact mass
179.0754
XLogP
-0.68
TPSA
69.56
H-bond donors
3
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
50.57
Supplementary Information
Details werden geladen…
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