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CS-W001157 4
Total: USD 88.00

Methyl 5-cyano-1H-pyrrole-3-carboxylate

  • CAS No. 66832-08-4

  • Cat. No. CS-0567130
  • Purity≥98%
  • MDL No.MFCD18830799

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

Methyl 5-cyano-1H-pyrrole-3-carboxylate|CS-0567130

Structure of 66832-08-4

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General Information

  • CAS No. 66832-08-4
  • Cat. No. CS-0567130
  • Purity ≥98%
  • MDL No. MFCD18830799
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆N₂O₂
  • Molecular Weight 150.13
  • Synonym(s) 1H-Pyrrole-3-carboxylicacid,5-cyano-,methylester(9CI)
  • SMILES O=C(C1=CNC(C#N)=C1)OC

Synthesis

  • Route1
    • null|null
      124-41-4
    • 4-(2,2,2-Trichloroacetyl)-1H-pyrrole-2-carbonitrile|CS-0454758
      66832-07-3
    • ~10%
    • In-stock
      Methyl 5-cyano-1H-pyrrole-3-carboxylate|CS-0567130
      66832-08-4

    References

    • BAYER PHARMACEUTICALS CORPORATION Patent: WO2007/64883 A2, 2007 ; Location in patent: Page/Page column 197-198 ;

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-H312-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   65.88
  • LogP   0.67298
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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