이름: 1-(2-fluoro-4-nitrophenyl)-2,3-dihydro-1H-pyridin-4-one
SMILES:
O=C1C=CN(c2ccc([N+](=O)[O-])cc2F)CC1Molecular Processing
Molecular formula
C11H9FN2O3
Molecular weight
236.2
Exact mass
236.0597
XLogP
2.03
TPSA
63.45
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
59.16
Supplementary Information
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