SMILES:
Cc1ccc(S(=O)(=O)N=C=O)cc1Molecular Processing
Molecular formula
C8H7NO3S
Molecular weight
197.22
Exact mass
197.0147
XLogP
1.02
TPSA
63.57
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
13
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
0.125
Molar refractivity
46.49
Supplementary Information
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