Base information

Cat. No.
CAS No.4043-96-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C12H8N2NaO8P
Molecular Weight 362.164
Exact Mass 361.992
XLogP3 4.5458
Mr 80.077
PSA 160.04
Sequence -
Atom number 32
Bond number 32
Ring number 2
Rotor number 6
Residues number 0
Canonical smiles [O-]P(=O)(Oc1ccc(cc1)[N+](=O)[O-])Oc1ccc(cc1)[N+](=O)[O-].[Na+]

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