이름: 2-cyclopropyl-3-(1,1-difluoroethoxy)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
SMILES:
CC(F)(F)Oc1cc(B2OC(C)(C)C(C)(C)O2)cnc1C1CC1Molecular Processing
Molecular formula
C16H22BF2NO3
Molecular weight
325.16
Exact mass
325.1661
XLogP
3.25
TPSA
40.58
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.688
Molar refractivity
83.18
Supplementary Information
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