Base information

Cat. No.
CAS No.87240-07-1
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H5BrN2O2
Molecular Weight 241.041
Exact Mass 239.953
XLogP3 3.3618
Mr 54.8207
PSA 61.61
Sequence -
Atom number 18
Bond number 19
Ring number 2
Rotor number 1
Residues number 0
Canonical smiles [O-][N+](=O)c1cc(Br)c2c(c1)cc[nH]2

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