SMILES:
O=S(=O)(O)c1ccc(O)cc1Molecular Processing
Molecular formula
C6H6O4S
Molecular weight
174.18
Exact mass
173.9987
XLogP
0.64
TPSA
74.6
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
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
Molar refractivity
37.92
Supplementary Information
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