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CS-W001157 4
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Methyl 4'-cyano-[1,1'-biphenyl]-4-carboxylate

  • CAS No. 89900-95-8

  • Cat. No. CS-0111071
  • Purity≥98%
  • MDL No.MFCD03791240

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

Methyl 4'-cyano-[1,1'-biphenyl]-4-carboxylate|CS-0111071

Structure of 89900-95-8

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General Information

  • CAS No. 89900-95-8
  • Cat. No. CS-0111071
  • Purity ≥98%
  • MDL No. MFCD03791240
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₁NO₂
  • Molecular Weight 237.25
  • Synonym(s) Methyl 4'-cyano[1,1'-biphenyl]-4-carboxylate
  • SMILES O=C(OC)C1=CC=C(C=C1)C2=CC=C(C=C2)C#N

Synthesis

  • Route1

    References

    • Piller, Fabian M.; Appukkuttan, Prasad; Gavryushin, Andrei; Helm, Matthew; Knochel, Paul Angewandte Chemie - International Edition, 2008 , vol. 47, # 36 p. 6802 - 6806
  • Route2

    References

    • Angewandte Chemie - International Edition, , vol. 47, # 11 p. 2089 - 2092
  • Route3

    References

    • Yang, Yun-Chin; Luh, Tien-Yau Journal of Organic Chemistry, 2003 , vol. 68, # 25 p. 9870 - 9873

Safety Information

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Computational Chemistry Data

  • TPSA   50.09
  • LogP   3.01188
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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