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Cyanomethyl 2-(phenylformamido)acetate

  • CAS No. 4816-94-8

  • Cat. No. CS-0220557
  • Purity≥98%
  • MDL No.None

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

Cyanomethyl 2-(phenylformamido)acetate|CS-0220557

Structure of 4816-94-8

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General Information

  • CAS No. 4816-94-8
  • Cat. No. CS-0220557
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀N₂O₃
  • Molecular Weight 218.21
  • Synonym(s) Cyanomethyl (benzoylamino)acetate
  • SMILES O=C(OCC#N)CNC(C1=CC=CC=C1)=O

Synthesis

  • Route1

    References

    • Shin, Ho-Sang; Kim, Seungki; Myung, Seung-Woon; Park, Jong-Sei Analytical Chemistry, 1995 , vol. 67, # 11 p. 1853 - 1859
  • Route2

    References

    • Shin, Ho-Sang; Kim, Seungki; Myung, Seung-Woon; Park, Jong-Sei Analytical Chemistry, 1995 , vol. 67, # 11 p. 1853 - 1859
  • Route3
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    • Cyanomethyl 2-(phenylformamido)acetate|CS-0220557
      4816-94-8

    References

    • Stewart,F.H.C. Australian Journal of Chemistry, 1965 , vol. 18, p. 1089 - 1094

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   79.19
  • LogP   0.48318
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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