Base information

Cat. No.
CAS No.21080-92-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C7H6O4S
Molecular Weight 186.185
Exact Mass 185.999
XLogP3 1.0009
Mr 42.4426
PSA 102.84
Sequence -
Atom number 18
Bond number 18
Ring number 1
Rotor number 3
Residues number 0
Canonical smiles OC(=O)C(c1cscc1)C(=O)O

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