SMILES:
CCc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NMolecular Processing
Molecular formula
C8H9N3O4
Molecular weight
211.18
Exact mass
211.0593
XLogP
1.65
TPSA
112.3
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
53.54
Supplementary Information
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