Base information

Cat. No.
CAS No.5930-92-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C7H8N2O4
Molecular Weight 184.149
Exact Mass 184.048
XLogP3 1.6228
Mr 45.7012
PSA 87.91
Sequence -
Atom number 21
Bond number 21
Ring number 1
Rotor number 4
Residues number 0
Canonical smiles [O-][N+](=O)c1cc([nH]c1)C(=O)OCC

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