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CS-W001157 4
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Methyl 3-(5-formyl-2,4-dimethyl-1H-pyrrol-3-yl)propanoate

  • CAS No. 18818-25-2

  • Cat. No. CS-0035964
  • Purity95+%
  • MDL No.None

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

Methyl 3-(5-formyl-2,4-dimethyl-1H-pyrrol-3-yl)propanoate|CS-0035964

Structure of 18818-25-2

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General Information

  • CAS No. 18818-25-2
  • Cat. No. CS-0035964
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₅NO₃
  • Molecular Weight 209.24
  • Synonym(s) 5-FORMYL-2,4-DIMETHYLPYRROLE-3-PROPIONIC ACID, METHYL ESTER
  • SMILES CC1=C(C=O)NC(=C1CCC(=O)OC)C

Synthesis

  • Route1
    • null|null
      3724-43-4
    • Methyl 3-(2,4-dimethyl-1H-pyrrol-3-yl)propanoate|CS-1634974
      54474-51-0
    • ~60%
    • Methyl 3-(5-formyl-2,4-dimethyl-1H-pyrrol-3-yl)propanoate|CS-0035964
      18818-25-2

    References

    • Sugen, Inc. Patent: US6689806 B1, 2004 ; Location in patent: Page/Page column 96 ; US 6689806 B1
  • Route2
    • null|null
      13219-76-6
    • ~75%
    • Methyl 3-(5-formyl-2,4-dimethyl-1H-pyrrol-3-yl)propanoate|CS-0035964
      18818-25-2

    References

    • Lash, Timothy D.; Mani, Ukti N.; Lyons, Elizabeth A.; Thientanavanich, Pornlert; Jones, Marjorie A. Journal of Organic Chemistry, 1999 , vol. 64, # 2 p. 478 - 487
  • Route3

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 17, # 17 p. 4812 - 4818

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   59.16
  • LogP   1.54964
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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