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CS-W001157 4
Total: USD 88.00

Methyl (2-cyanoethyl)glycinate

  • CAS No. 44915-39-1

  • Cat. No. CS-0511160
  • Molecule weight142.16
  • Purity≥98%
  • MDL No.None

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

Methyl (2-cyanoethyl)glycinate|CS-0511160

Structure of 44915-39-1

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General Information

  • CAS No. 44915-39-1
  • Cat. No. CS-0511160
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀N₂O₂
  • Molecular Weight 142.16
  • Synonym(s) Methyl [(2-cyanoethyl)amino]acetate
  • SMILES O=C(OC)CNCCC#N

Synthesis

  • Route1

    References

    • Biftu, Tesfaye; Feng, Dennis; Qian, Xiaoxia; Liang, Gui-Bai; Kieczykowski, Gerard; Eiermann, George; He, Huaibing; Leiting, Barbara; Lyons, Kathy; Petrov, Aleksandr; Sinha-Roy, Ranabir; Zhang, Bei; Scapin, Giovanna; Patel, Sangita; Gao, Ying-Duo; Singh, Suresh; Wu, Joseph; Zhang, Xiaoping; Thornberry, Nancy A.; Weber, Ann E. Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 1 p. 49 - 52
  • Route2
    • null|null
      67-56-1
    • N-(2-Cyanoethyl)glycine|CS-0201685
      3088-42-4
    • ~%
    • Methyl (2-cyanoethyl)glycinate|CS-0511160
      44915-39-1

    References

    • Fancelli, Daniele; Berta, Daniela; Bindi, Simona; Cameron, Alexander; Cappella, Paolo; Carpinelli, Patrizia; Catana, Cornel; Forte, Barbara; Giordano, Patrizia; Giorgini, Maria Laura; Mantegani, Sergio; Marsiglio, Aurelio; Meroni, Maurizio; Moll, Juergen; Pittala, Valeria; Roletto, Fulvia; Severino, Dino; Soncini, Chiara; Storici, Paola; Tonani, Roberto; Varasi, Mario; Vulpetti, Anna; Vianello, Paola Journal of Medicinal Chemistry, 2005 , vol. 48, # 8 p. 3080 - 3084
  • Route3
    • null|null
      107-13-1
    • Methyl glycinate|CS-0454289
      616-34-2
    • ~52%
    • Methyl (2-cyanoethyl)glycinate|CS-0511160
      44915-39-1

    References

    • Negrebetskii, Vad. V.; Kolesova, V. A.; Bobkova, R. G.; Chimishkyan, A. L.; Shvetsov-Shilovskii, N. I. J. Gen. Chem. USSR (Engl. Transl.), 1991 , vol. 61, # 1.1 p. 104 - 108

Safety Information

Download SDS
GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   62.12
  • LogP   -0.33732
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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