Base information

Cat. No.
CAS No.116632-33-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C9H5BrN2O2
Molecular Weight 253.052
Exact Mass 251.953
XLogP3 3.4287
Mr 58.265
PSA 58.71
Sequence -
Atom number 19
Bond number 20
Ring number 2
Rotor number 1
Residues number 0
Canonical smiles Brc1cnc2c(c1)c(ccc2)[N+](=O)[O-]

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