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CAS 330645-87-9

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1-[Bis(dimethylamino)methylene]-5-chloro-1H-benzotriazolium 3-oxide hexafluorophosphate(1-) (1:1)

Description:
1-[Bis(dimethylamino)methylene]-5-chloro-1H-benzotriazolium 3-oxide hexafluorophosphate(1-) is a complex organic compound characterized by its unique structure, which includes a benzotriazole moiety and a hexafluorophosphate counterion. This substance typically exhibits properties such as high solubility in polar organic solvents, making it useful in various chemical applications, including as a reagent in organic synthesis and as a potential catalyst. The presence of the bis(dimethylamino)methylene group contributes to its nucleophilic characteristics, while the chloro substituent may influence its reactivity and stability. The hexafluorophosphate anion is known for its ability to stabilize cationic species, enhancing the compound's overall stability in solution. Additionally, this compound may exhibit interesting photophysical properties, which can be leveraged in materials science and photochemistry. Safety considerations should be taken into account due to the potential toxicity associated with the dimethylamino groups and the halogenated components. Overall, this compound represents a versatile building block in advanced chemical research and applications.
Formula:C11H15ClN5O·F6P
InChI:InChI=1S/C11H15ClN5O.F6P/c1-14(2)11(15(3)4)16-9-6-5-8(12)7-10(9)17(18)13-16;1-7(2,3,4,5)6/h5-7H,1-4H3;/q+1;-1
InChI key:InChIKey=AFTGMAUNHUBGAW-UHFFFAOYSA-N
SMILES:C(N(C)C)(N(C)C)=[N+]1C=2C(N(=O)=N1)=CC(Cl)=CC2.[P+5]([F-])([F-])([F-])([F-])([F-])[F-]
Synonyms:
  • 1-[Bis(dimethylamino)methylene]-5-chloro-1H-benzotriazolium 3-oxide hexafluorophosphate(1-) (1:1)
  • 1H-Benzotriazolium, 1-[bis(dimethylamino)methylene]-5-chloro-, 3-oxide, hexafluorophosphate(1-) (1:1)
  • 1H-Benzotriazolium, 1-[bis(dimethylamino)methylene]-5-chloro-, hexafluorophosphate(1-), 3-oxide
  • 5-Chloro-1-[Bis(Dimethylamino)Methylene]-1H-Benzotriazolium 3-Oxide Hexafluorophosphate
  • 5-Chloro-1-[Bis(dimethylamino)methylene]-1H-Benzotriazolium3-Oxide Hexafluorophosphate
  • N-{[(6-chloro-1H-benzotriazol-1-yl)oxy](dimethylamino)methylidene}-N-methylmethanaminium fluoride- pentafluoro-λ5-phosphane (1:1)
  • O-(6-Chloro-1-hydrocibenzotriazol-1-yl)-1,1,3,3-tetramethyluroniumhexafluorophosphate
  • O-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Hexafluorophosphate
  • [(6-Chlorobenzotriazol-1-Yl)Oxy-(Dimethylamino)Methylidene]-Dimethylazanium,Hexafluorophosphate
  • HCTU
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