1,1'-Trimethylene-Bis(4-Formylpyridinium Bromide) Dioxime
[CAS# 56-97-3]

Identification

• Classification: API >> Special medicine >> Antidote
• Name: 1,1'-Trimethylene-Bis(4-Formylpyridinium Bromide) Dioxime
• Synonyms: Oxo-[[1-[3-[4-(Oxoazaniumylmethylene)-1-Pyridyl]Propyl]-4-Pyridylidene]Methyl]Ammonium Dibromide; Keto-[[1-[3-[4-(Ketoazaniumylmethylene)-1-Pyridyl]Propyl]-4-Pyridylidene]Methyl]Ammonium Dibromide; St5409962
• Molecular Formula: C₁₅H₁₈Br₂N₄O₂
• Molecular Weight: 446.14
• CAS Registry Number: 56-97-3
• EINECS: 200-304-5
• SMILES: [NH+](=O)\C=C2/C=CN(CCCN1C=C\C(C=C1)=C/[NH+]=O)C=C2.[Br-].[Br-]
• InChI: 1S/C15H16N4O2.2BrH/c20-16-12-14-2-8-18(9-3-14)6-1-7-19-10-4-15(5-11-19)13-17-21;;/h2-5,8-13H,1,6-7H2;2*1H
• InChIKey: JHZHWVQTOXIXIV-UHFFFAOYSA-N

Properties

• Boiling point: 412.9°C at 760 mmHg (Cal.)
• Flash point: 203.5°C (Cal.)

References

• (1): Guillaume Mercey, Tristan Verdelet, Géraldine Saint-André, Emilie Gillon, Alain Wagner, Rachid Baati, Ludovic Jean, Florian Nachon and Pierre-Yves Renard. First efficient uncharged reactivators for the dephosphylation of poisoned human acetylcholinesterase, Chem. Commun., 2011, 47, 5295.