Название: methyl 2-bromo-5-fluoroisonicotinate
SMILES:
COC(=O)c1cc(Br)ncc1FMolecular Processing
Molecular formula
C7H5BrFNO2
Molecular weight
234.02
Exact mass
232.9488
XLogP
1.77
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
43.23
Supplementary Information
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