SMILES:
Cc1nc2cccc(B3OC(C)(C)C(C)(C)O3)c2o1Molecular Processing
Molecular formula
C14H18BNO3
Molecular weight
259.11
Exact mass
259.138
XLogP
2.44
TPSA
44.49
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
74.46
Supplementary Information
Obteniendo detalles…
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