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CS-W001157 4
Total: USD 88.00

Dimethyl 1H-pyrrole-2,4-dicarboxylate

  • CAS No. 2818-07-7

  • Cat. No. CS-W022627
  • Purity≥97%
  • MDL No.MFCD02179576

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

Dimethyl 1H-pyrrole-2,4-dicarboxylate|CS-W022627

Structure of 2818-07-7

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General Information

  • CAS No. 2818-07-7
  • Cat. No. CS-W022627
  • Purity ≥97%
  • MDL No. MFCD02179576
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO₄
  • Molecular Weight 183.16
  • Synonym(s) 1H-Pyrrole-2,4-dicarboxylic acid, dimethyl ester
  • SMILES O=C(C1=CC(C(OC)=O)=CN1)OC

Synthesis

  • Route1
    • null|null
      39687-95-1
    • null|null
      922-67-8
    • ~48%
    • In-stock
      Dimethyl 1H-pyrrole-2,4-dicarboxylate|CS-W022627
      2818-07-7

    References

    • AMBIT BIOSCIENCES CORPORATION; ABRAHAM, Sunny; CHAO, Qi; HADD. Michael, J.; HOLLADAY, Mark, W.; LIU, Gang; NAMBU, Mitchell, D.; SETTI, Eduardo Patent: WO2010/2472 A1, 2010 ; Location in patent: Page/Page column 118-119 ; WO 2010/002472 A1
  • Route2
    • null|null
      67-56-1
    • 5-(Methoxycarbonyl)-1H-pyrrole-3-carboxylic acid|CS-0567105
      67858-48-4
    • ~96%
    • In-stock
      Dimethyl 1H-pyrrole-2,4-dicarboxylate|CS-W022627
      2818-07-7

    References

    • Meyers, Kenneth M.; Mendez-Andino, Jose; Colson, Anny-Odile; Hu, X. Eric; Wos, John A.; Mitchell, Maria C.; Hodge, Karen; Howard, Jeremy; Paris, Jennifer L.; Dowty, Martin E.; Obringer, Cindy M.; Reizes, Ofer Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 3 p. 657 - 661
  • Route3

    References

    • Meyers, Kenneth M.; Mendez-Andino, Jose; Colson, Anny-Odile; Hu, X. Eric; Wos, John A.; Mitchell, Maria C.; Hodge, Karen; Howard, Jeremy; Paris, Jennifer L.; Dowty, Martin E.; Obringer, Cindy M.; Reizes, Ofer Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 3 p. 657 - 661

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   68.39
  • LogP   0.5879
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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