SMILES:
O=S(=O)(c1ccccc1)c1cc(O)c2c(c1O)C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)ClMolecular Processing
Molecular formula
C17H8Cl6O4S
Molecular weight
521.03
Exact mass
517.8274
XLogP
5.69
TPSA
74.6
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.176
Molar refractivity
109.9
Supplementary Information
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