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CS-W001157 4
Total: USD 88.00

4-Bromo-1-methyl-3-phenyl-1H-pyrazole

  • CAS No. 105994-55-6

  • Cat. No. CS-0449582
  • Molecule weight237.10
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

4-Bromo-1-methyl-3-phenyl-1H-pyrazole|CS-0449582

Structure of 105994-55-6

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General Information

  • CAS No. 105994-55-6
  • Cat. No. CS-0449582
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉BrN₂
  • Molecular Weight 237.10
  • Synonym(s) 4-Bromo-1-methyl-3-phenyl-1H-pyrazole Hydrochloride Hydrate
  • SMILES CN1C=C(C(=N1)C2=CC=CC=C2)Br

Synthesis

  • Route1
    • 1-Methyl-3-phenyl-1H-pyrazole|CS-0151172
      3463-26-1
    • ~77%
    • 4-Bromo-1-methyl-3-phenyl-1H-pyrazole|CS-0449582
      105994-55-6

    References

    • Kano, Kunio; Scarpetti, David; Warner, John C.; Anselme, Jean-Pierre; Springer, James H.; Arison, Byron H. Canadian Journal of Chemistry, 1986 , vol. 64, p. 2211 - 2219
  • Route2
    • null|null
      3506-51-2
    • ~%
    • 4-Bromo-1-methyl-3-phenyl-1H-pyrazole|CS-0449582
      105994-55-6

    References

    • v. Auwers; Schmidt Chemische Berichte, 1925 , vol. 58, p. 537
  • Route3
    • null|null
      57623-20-8
    • ~%
    • 4-Bromo-1-methyl-3-phenyl-1H-pyrazole|CS-0449582
      105994-55-6

    References

    • v. Auwers; Schmidt Chemische Berichte, 1925 , vol. 58, p. 537

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   17.82
  • LogP   2.8496
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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