Base information

Cat. No.
CAS No.652-62-0
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C5H4F3N3O4
Molecular Weight 227.098
Exact Mass 227.015
XLogP3 0.7259
Mr 48.7283
PSA 110.67
Sequence -
Atom number 19
Bond number 19
Ring number 1
Rotor number 2
Residues number 0
Canonical smiles [O-][N+](=O)C1=C(O)NC(N=C1O)C(F)(F)F

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