O=[N+]([O-])c1ccc(S(=O)(=O)O)c([N+](=O)[O-])c1[N+](=O)[O-]
Name: trinitrobenzene sulfonic acid
SMILES: O=[N+]([O-])c1ccc(S(=O)(=O)O)c([N+](=O)[O-])c1[N+](=O)[O-]

Molecular Processing

Molecular formula
C6H3N3O9S
Molecular weight
293.17
Exact mass
292.959
XLogP
0.66
TPSA
183.79
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0
Molar refractivity
56.22

Supplementary Information

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Involved in 2 reactions