Name: 2-bromo-1-[3-chloro-5-(2,2,2-trifluoroethoxy)pyridin-2-yl]ethanone
SMILES:
O=C(CBr)c1ncc(OCC(F)(F)F)cc1ClMolecular Processing
Molecular formula
C9H6BrClF3NO2
Molecular weight
332.5
Exact mass
330.9223
XLogP
3.25
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
58.92
Supplementary Information
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Involved in 2 reactions→