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CS-W001157 4
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2-Cyano-5-fluorobenzyl bromide

  • CAS No. 421552-12-7

  • Cat. No. CS-W019482
  • Purity≥98%
  • MDL No.MFCD08059542

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

2-Cyano-5-fluorobenzyl bromide|CS-W019482

Structure of 421552-12-7

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General Information

  • CAS No. 421552-12-7
  • Cat. No. CS-W019482
  • Purity ≥98%
  • MDL No. MFCD08059542
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅BrFN
  • Molecular Weight 214.04
  • Synonym(s) Benzonitrile, 2-(bromomethyl)-4-fluoro-
  • SMILES FC1=CC=C(C#N)C(CBr)=C1

Synthesis

  • Route1

    References

    • Zhang, Zhiyuan; Wallace, Michael B.; Feng, Jun; Stafford, Jeffrey A.; Skene, Robert J.; Shi, Lihong; Lee, Bumsup; Aertgeerts, Kathleen; Jennings, Andy; Xu, Rongda; Kassel, Daniel B.; Kaldor, Stephen W.; Navre, Marc; Webb, David R.; Gwaltney, Stephen L. Journal of Medicinal Chemistry, 2011 , vol. 54, # 2 p. 510 - 524
  • Route2
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    • In-stock
      2-Cyano-5-fluorobenzyl bromide|CS-W019482
      421552-12-7

    References

    • Zhang, Zhiyuan; Wallace, Michael B.; Feng, Jun; Stafford, Jeffrey A.; Skene, Robert J.; Shi, Lihong; Lee, Bumsup; Aertgeerts, Kathleen; Jennings, Andy; Xu, Rongda; Kassel, Daniel B.; Kaldor, Stephen W.; Navre, Marc; Webb, David R.; Gwaltney, Stephen L. Journal of Medicinal Chemistry, 2011 , vol. 54, # 2 p. 510 - 524

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 2923
Class : 8 (6.1)
Packing Group : Ⅲ
Hazard Statements : H302+H312+H332-H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.59228
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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