Base information

Cat. No.
CAS No.3668-93-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C9H8N4O5
Molecular Weight 252.184
Exact Mass 252.049
XLogP3 1.2519
Mr 67.6117
PSA 120.73
Sequence -
Atom number 26
Bond number 27
Ring number 2
Rotor number 3
Residues number 0
Canonical smiles O=C1NC(=O)N(C1C)N=Cc1ccc(o1)[N+](=O)[O-]

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