Base information

Cat. No.
CAS No.3395-03-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H8N2O6
Molecular Weight 228.159
Exact Mass 228.038
XLogP3 2.5666
Mr 57.07
PSA 110.1
Sequence -
Atom number 24
Bond number 24
Ring number 1
Rotor number 4
Residues number 0
Canonical smiles COc1cc([N+](=O)[O-])c(cc1OC)[N+](=O)[O-]

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