Base information

Cat. No.
CAS No.82782-85-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H7NO2S
Molecular Weight 181.212
Exact Mass 181.02
XLogP3 2.016
Mr 47.4552
PSA 70.33
Sequence -
Atom number 19
Bond number 20
Ring number 2
Rotor number 2
Residues number 0
Canonical smiles COC(=O)c1cc2c([nH]1)ccs2

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