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CS-W001157 4
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(S)-methyl 2-cyclohexyl-2-(pyrazine-2-carboxamido)acetate

  • CAS No. 848777-29-7

  • Cat. No. CS-M1836
  • Molecule weight277.32
  • Purity≥98%
  • MDL No.None

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

(S)-methyl 2-cyclohexyl-2-(pyrazine-2-carboxamido)acetate|CS-M1836

Structure of 848777-29-7

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General Information

  • CAS No. 848777-29-7
  • Cat. No. CS-M1836
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₉N₃O₃
  • Molecular Weight 277.32
  • Synonym(s) (αS)-α-[(2-Pyrazinylcarbonyl)amino]-Cyclohexaneacetic Acid Methyl Ester
  • SMILES O=C(N[C@H](C(OC)=O)C1CCCCC1)C2=CN=CC=N2

Synthesis

  • Route1
    • Pyrazine-2-carboxylic acid Bortezomib Impurity|CS-0169692
      98-97-5
    • Methyl (S)-2-amino-2-cyclohexylacetate|CS-0471341
      145618-11-7
    • ~94%
    • (S)-methyl 2-cyclohexyl-2-(pyrazine-2-carboxamido)acetate|CS-M1836
      848777-29-7

    References

    • VERENIGING VOOR CHRISTELIJK HOGER ONDERWIJS, WETENSCHAPPELIJK ONDERZOEK EN PATIENTENZORG; RUIJTER, Eelco; ORRU, Romano; ZNABET, Anass; POLAK, Marloes; TURNER, Nicholas Patent: WO2011/103932 A1, 2011 ; Location in patent: Page/Page column 42; 43 ;
  • Route2

    References

    • SCHERING CORPORATION; ARASAPPAN, Ashok Patent: WO2005/58821 A1, 2005 ; Location in patent: Page/Page column 56-57 ; WO 2005/058821 A1
  • Route3

    References

    • Schering Corporation Patent: US2006/276406 A1, 2006 ; Location in patent: Page/Page column 453-454 ; US 20060276406 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   81.18
  • LogP   1.3283
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   4

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