SMILES:
NS(=O)(=O)c1ccccc1OCC1CO1Molecular Processing
Molecular formula
C9H11NO4S
Molecular weight
229.26
Exact mass
229.0409
XLogP
0.11
TPSA
81.92
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
53.05
Supplementary Information
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