Base information

Cat. No.
CAS No.89166-85-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C5H2ClNO4S
Molecular Weight 207.592
Exact Mass 206.939
XLogP3 2.5311
Mr 45.1103
PSA 111.36
Sequence -
Atom number 14
Bond number 14
Ring number 1
Rotor number 2
Residues number 0
Canonical smiles [O-][N+](=O)c1cc(sc1Cl)C(=O)O

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