SMILES:
O=C1CCN1c1cccc([N+](=O)[O-])c1Molecular Processing
Molecular formula
C9H8N2O3
Molecular weight
192.17
Exact mass
192.0535
XLogP
1.33
TPSA
63.45
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
50.07
Supplementary Information
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