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CAS 1029636-11-0

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4-Chloro-5-phenyl-3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-1H-pyrazole

Description:
4-Chloro-5-phenyl-3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-1H-pyrazole is a synthetic organic compound characterized by its complex structure, which includes a pyrazole ring, a phenyl group, and a tridecafluorohexyl substituent. The presence of the chloro group introduces a halogen, which can influence the compound's reactivity and solubility. The tridecafluorohexyl group, consisting of multiple fluorine atoms, imparts unique properties such as increased hydrophobicity and thermal stability, making the compound potentially useful in various applications, including agrochemicals and materials science. The compound's molecular structure suggests it may exhibit interesting biological activities, although specific biological data would need to be referenced for detailed insights. Additionally, its CAS number, 1029636-11-0, allows for easy identification in chemical databases, facilitating research and development efforts. Overall, this compound exemplifies the intricate design often found in modern synthetic chemistry, combining multiple functional groups to achieve desired properties.
Formula:C15H6ClF13N2
InChI:InChI=1S/C15H6ClF13N2/c16-7-8(6-4-2-1-3-5-6)30-31-9(7)10(17,18)11(19,20)12(21,22)13(23,24)14(25,26)15(27,28)29/h1-5H,(H,30,31)
InChI key:InChIKey=BTMMUSAFNUBEGT-UHFFFAOYSA-N
SMILES:C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)(F)C=1C(Cl)=C(NN1)C2=CC=CC=C2
Synonyms:
  • 1H-Pyrazole, 4-chloro-5-phenyl-3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-
  • 4-Chloro-5-phenyl-3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-1H-pyrazole
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