Name: 2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-pyrimidine
SMILES:
CC1(C)OB(c2ccc(Oc3ncccn3)cc2)OC1(C)CMolecular Processing
Molecular formula
C16H19BN2O3
Molecular weight
298.15
Exact mass
298.1489
XLogP
2.57
TPSA
53.47
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
84.26
Supplementary Information
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Involved in 3 reactions→