NS(=O)(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1Nc1ccccc1
SMILES: NS(=O)(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1Nc1ccccc1

Molecular Processing

Molecular formula
C13H11N3O6S
Molecular weight
337.31
Exact mass
337.0369
XLogP
1.68
TPSA
152.63
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0
Molar refractivity
81.15

Supplementary Information

Details werden geladen…

An 48 Reaktionen beteiligt