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CS-W001157 4
Total: USD 88.00

4-Bromo-2,2-diphenylbutyronitrile Diphenoxylate Impurity

  • CAS No. 39186-58-8

  • Cat. No. CS-0228916
  • Purity≥98%
  • MDL No.MFCD00001845

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

4-Bromo-2,2-diphenylbutyronitrile Diphenoxylate  Impurity|CS-0228916

Structure of 39186-58-8

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General Information

  • CAS No. 39186-58-8
  • Cat. No. CS-0228916
  • Purity ≥98%
  • MDL No. MFCD00001845
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₄BrN
  • Molecular Weight 300.20
  • Synonym(s) None
  • SMILES C2=C(C(C1=CC=CC=C1)(CCBr)C#N)C=CC=C2

Synthesis

  • Route1

    References

    • Hou, Xueling; Ge, Zemei; Wang, Tingmin; Guo, Wei; Wu, Jun; Cui, Jingrong; Lai, Chingsan; Li, Runtao Archiv der Pharmazie, 2011 , vol. 344, # 5 p. 320 - 332
  • Route2

    References

    • Bockmuehl; Ehrhart Justus Liebigs Annalen der Chemie, 1949 , vol. 561, p. 52,76 Full Text Show Details Dupre et al. Journal of the Chemical Society, 1949 , p. 500,505

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H312+H332
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   4.28128
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   4

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