SMILES:
CC(=O)c1ccc(C(=O)CCl)s1Molecular Processing
Molecular formula
C8H7ClO2S
Molecular weight
202.66
Exact mass
201.9855
XLogP
2.37
TPSA
34.14
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
49.37
Supplementary Information
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