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Methyl 5-formyl-2-methylfuran-3-carboxylate

  • CAS No. 81661-26-9

  • Cat. No. CS-0254463
  • Molecule weight168.15
  • Purity≥97%
  • MDL No.None

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

Methyl 5-formyl-2-methylfuran-3-carboxylate|CS-0254463

Structure of 81661-26-9

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General Information

  • CAS No. 81661-26-9
  • Cat. No. CS-0254463
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈O₄
  • Molecular Weight 168.15
  • Synonym(s) METHYL 5-FORMYL-2-METHYL-3-FUROATE
  • SMILES O=C(C1=C(C)OC(C=O)=C1)OC

Synthesis

  • Route1

    References

    • Stephen; Hashmi; Woelfle; Ata, Filiz; Hamzic, Melissa; Salathe, Ralph; Frey, Wolfgang Advanced Synthesis and Catalysis, 2006 , vol. 348, # 16-17 p. 2501 - 2508
  • Route2

    References

    • EVOTEC NEUROSCIENCES GMBH; MADDEN, James; HALLETT, David James; PARKES, Alastair; RAOOF, Ali; WANG, Xialou Patent: WO2010/20556 A1, 2010 ; Location in patent: Page/Page column 126-127 ; WO 2010/020556 A1
  • Route3
    • null|null
      17651-08-0
    • ~41%
    • Methyl 5-formyl-2-methylfuran-3-carboxylate|CS-0254463
      81661-26-9

    References

    • Ballesteros, Juan Sanchez; McPhee, Derek James; Hernandez, Dolores Hernandez Bulletin de la Societe Chimique de France, 1982 , vol. 2, # 5-6 p. 176 - 180

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-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   56.51
  • LogP   1.18712
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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