Base information

Cat. No.
CAS No.465514-11-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H5NO2S
Molecular Weight 179.196
Exact Mass 179.004
XLogP3 2.2156
Mr 45.2035
PSA 71.34
Sequence -
Atom number 17
Bond number 18
Ring number 2
Rotor number 2
Residues number 0
Canonical smiles O=Cc1noc(c1)c1cccs1

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