SMILES:
CC(C)Oc1cccc([N+](=O)[O-])c1NMolecular Processing
Molecular formula
C9H12N2O3
Molecular weight
196.21
Exact mass
196.0848
XLogP
1.96
TPSA
78.39
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
14
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
0.333
Molar refractivity
53.27
Supplementary Information
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