Base information

Cat. No.
CAS No.21594-54-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C6H3N3O4
Molecular Weight 181.106
Exact Mass 181.012
XLogP3 0.9475
Mr 43.4517
PSA 104.71
Sequence -
Atom number 16
Bond number 17
Ring number 2
Rotor number 1
Residues number 0
Canonical smiles [O-][N+](=O)c1cnc2c(c1)oc(=O)[nH]2

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