이름: 2-bromo-1-(3,5-dichloropyridin-2-yl)ethanone-O-ethyloxime
SMILES:
CCON=C(CBr)c1ncc(Cl)cc1ClMolecular Processing
Molecular formula
C9H9BrCl2N2O
Molecular weight
311.99
Exact mass
309.9275
XLogP
3.52
TPSA
34.48
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
66.21
Supplementary Information
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