Base information

Cat. No.
CAS No.130773-02-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C12H9ClN2O5S
Molecular Weight 328.728
Exact Mass 327.992
XLogP3 0.3218
Mr 75.705
PSA 128.47
Sequence -
Atom number 30
Bond number 30
Ring number 2
Rotor number 3
Residues number 0
Canonical smiles CS/C=C(/C1C(=O)C(=O)C(=O)C(=O)C1=O)\n1cncc1.Cl

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