Name: title compound
SMILES:
O=C1CCSc2c(Cl)ccc(Cl)c21Molecular Processing
Molecular formula
C9H6Cl2OS
Molecular weight
233.12
Exact mass
231.9516
XLogP
3.67
TPSA
17.07
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
56.13
Supplementary Information
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