Name: 3-cyanopyridine-5-boronic acid pinacol ester
SMILES:
CC1(C)OB(c2cncc(C#N)c2)OC1(C)CMolecular Processing
Molecular formula
C12H15BN2O2
Molecular weight
230.08
Exact mass
230.1227
XLogP
1.25
TPSA
55.14
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
17
Rings
2
Aromatic rings
1
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
64.67
Supplementary Information
Details werden geladen…
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