CS(=O)(=O)c1ccc(C(=O)C2=C(Cl)CCCC2=O)c(Cl)c1
Name: 3-Chloro-2-(2-chloro-4-methanesulfonylbenzoyl) -cyclohex-2-enone
SMILES: CS(=O)(=O)c1ccc(C(=O)C2=C(Cl)CCCC2=O)c(Cl)c1

Molecular Processing

Molecular formula
C14H12Cl2O4S
Molecular weight
347.22
Exact mass
345.9833
XLogP
3.17
TPSA
68.28
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
80.63

Supplementary Information

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Involved in 7 reactions→

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