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CS-W001157 4
Total: USD 88.00

2-(2,5-Dibromophenyl)acetonitrile

  • CAS No. 74533-21-4

  • Cat. No. CS-0157667
  • Molecule weight274.94
  • Purity≥95%
  • MDL No.MFCD11618143

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

2-(2,5-Dibromophenyl)acetonitrile|CS-0157667

Structure of 74533-21-4

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General Information

  • CAS No. 74533-21-4
  • Cat. No. CS-0157667
  • Purity ≥95%
  • MDL No. MFCD11618143
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅Br₂N
  • Molecular Weight 274.94
  • Synonym(s) 2,5-DIBROMOBENZENE ACETONITRILE
  • SMILES C1=C(C=C(CC#N)C(=C1)Br)Br

Synthesis

  • Route1
    • null|null
      151-50-8
    • null|null
      642091-49-4
    • ~51%
    • 2-(2,5-Dibromophenyl)acetonitrile|CS-0157667
      74533-21-4

    References

    • Szczepankiewicz, Bruce G.; Kosogof, Christi; Nelson, Lissa T. J.; Liu, Gang; Liu, Bo; Zhao, Hongyu; Serby, Michael D.; Xin, Zhili; Liu, Mei; Gum, Rebecca J.; Haasch, Deanna L.; Wang, Sanyi; Clampit, Jill E.; Johnson, Eric F.; Lubben, Thomas H.; Stashko, Michael A.; Olejniczak, Edward T.; Sun, Chaohong; Dorwin, Sarah A.; Haskins, Kristi; Abad-Zapatero, Cele; Fry, Elizabeth H.; Hutchins, Charles W.; Sham, Hing L.; Rondinone, Cristina M.; Trevillyan, James M. Journal of Medicinal Chemistry, 2006 , vol. 49, # 12 p. 3563 - 3580
  • Route2

    References

    • Kukosha, Tatyana; Trufilkina, Nadezhda; Katkevics, Martins Synlett, 2011 , # 17 p. 2525 - 2528
  • Route3

    References

    • Szczepankiewicz, Bruce G.; Kosogof, Christi; Nelson, Lissa T. J.; Liu, Gang; Liu, Bo; Zhao, Hongyu; Serby, Michael D.; Xin, Zhili; Liu, Mei; Gum, Rebecca J.; Haasch, Deanna L.; Wang, Sanyi; Clampit, Jill E.; Johnson, Eric F.; Lubben, Thomas H.; Stashko, Michael A.; Olejniczak, Edward T.; Sun, Chaohong; Dorwin, Sarah A.; Haskins, Kristi; Abad-Zapatero, Cele; Fry, Elizabeth H.; Hutchins, Charles W.; Sham, Hing L.; Rondinone, Cristina M.; Trevillyan, James M. Journal of Medicinal Chemistry, 2006 , vol. 49, # 12 p. 3563 - 3580

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   3.27768
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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