Base information

Cat. No.
CAS No.1232149-36-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C9H6BrN3O2
Molecular Weight 268.067
Exact Mass 266.964
XLogP3 3.5921
Mr 62.6694
PSA 84.73
Sequence -
Atom number 21
Bond number 22
Ring number 2
Rotor number 1
Residues number 0
Canonical smiles Brc1ccc2c(c1)ncc(c2N)[N+](=O)[O-]

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