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CS-W001157 4
Total: USD 88.00

Methyl 2-cyanoacetate

  • CAS No. 105-34-0

  • Cat. No. CS-W016657
  • Purity≥98%
  • MDL No.MFCD00001939

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

Methyl 2-cyanoacetate|CS-W016657

Structure of 105-34-0

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General Information

  • CAS No. 105-34-0
  • Cat. No. CS-W016657
  • Purity ≥98%
  • MDL No. MFCD00001939
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₅NO₂
  • Molecular Weight 99.09
  • Synonym(s) Methyl cyanoacetate
  • SMILES O=C(OC)CC#N

Description

Methyl cyanoacetate is the intermediate product in pharmaceutical organic synthesis as well as in the synthesis of some biologically active compounds used in agriculture. It undergoes calcite or fluorite catalyzed Knvenagel condensation with aromatic aldehydes, giving the corresponding arylidenemalononitriles and (E)--cyanocinnamic esters.Methyl cyanoacetate may be used in the synthesis of various 1,2,5-tricarbonyl compounds.

Synthesis

  • Route1

    References

    • US6700010 B1, ; Page column 2 ;
  • Route2
    • null|null
      67-56-1
    • null|null
      372-09-8
    • ~97%
    • In-stock
      Methyl 2-cyanoacetate|CS-W016657
      105-34-0

    References

    • Synthesis, , # 7 p. 547 - 551
  • Route3

    References

    • WO2012/109164 A1, ; Page/Page column 56 ; WO 2012/109164 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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.09
  • LogP   0.07308
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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