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Home > Encyclopedia > 4-Bromo-3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-phenyl-1H-pyrazole

4-Bromo-3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-phenyl-1H-pyrazole

4-Bromo-3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-phenyl-1H-pyrazole structure

4-Bromo-3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-phenyl-1H-pyrazole 

structure
  • CAS No:

    82633-52-1

  • Formula:

    C12H6BrF7N2

  • Chemical Name:

    4-Bromo-3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-phenyl-1H-pyrazole

  • Synonyms:

    1H-Pyrazole,4-bromo-3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-phenyl-;1H-Pyrazole,4-bromo-3-(heptafluoropropyl)-5-phenyl-;4-Bromo-3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-phenyl-1H-pyrazole

  • Categories:

    Organic Chemistry  >  Coordination Complexes

4-Bromo-3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-phenyl-1H-pyrazole Basic Attributes

391.08200

391.08

2933199090

Characteristics

28.68000

5.12860

1.662g/cm3

123-124ºC

275.9ºC at 760 mmHg

120.7ºC

1.42

Safety Information

36/37/38

26-36/37/39

Xi

4-Bromo-3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-phenyl-1H-pyrazole Use and Manufacturing

PFAS (per- and polyfluoroalkyl substances) -> OECD Category

Computed Properties

Molecular Weight:391.08
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:389.96026
Monoisotopic Mass:389.96026
Topological Polar Surface Area:28.7
Heavy Atom Count:22
Complexity:395
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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