SMILES:
COc1ccc(C)cc1S(=O)(=O)ClMolecular Processing
Molecular formula
C8H9ClO3S
Molecular weight
220.68
Exact mass
219.9961
XLogP
1.93
TPSA
43.37
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
0.25
Molar refractivity
50.77
Supplementary Information
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