Base information

Cat. No.
CAS No.586-10-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C7H8N2O3
Molecular Weight 168.15
Exact Mass 168.053
XLogP3 2.29
Mr 46.1604
PSA 81.07
Sequence -
Atom number 20
Bond number 20
Ring number 1
Rotor number 2
Residues number 0
Canonical smiles COc1cc(N)cc(c1)[N+](=O)[O-]

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