이름: 2-fluoro-5-(4-methoxypyridin-2-yl)nitrobenzene
SMILES:
COc1ccnc(-c2ccc(F)c([N+](=O)[O-])c2)c1Molecular Processing
Molecular formula
C12H9FN2O3
Molecular weight
248.21
Exact mass
248.0597
XLogP
2.8
TPSA
65.26
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
62.84
Supplementary Information
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