Name: 1-(4-fluoro-phenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
SMILES:
CC1(C)OB(c2ccnn2-c2ccc(F)cc2)OC1(C)CMolecular Processing
Molecular formula
C15H18BFN2O2
Molecular weight
288.13
Exact mass
288.1445
XLogP
2.31
TPSA
36.28
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
21
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
0.4
Molar refractivity
79.24
Supplementary Information
Details werden geladen…
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