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CS-W001157 4
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5-Formyl-2,4-dimethylpyrrole-3-carboxylic acid

  • CAS No. 253870-02-9

  • Cat. No. CS-W003265
  • Molecule weight167.16
  • Purity≥98%
  • MDL No.MFCD06202342

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

5-Formyl-2,4-dimethylpyrrole-3-carboxylic acid|CS-W003265

Structure of 253870-02-9

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General Information

  • CAS No. 253870-02-9
  • Cat. No. CS-W003265
  • Purity ≥98%
  • MDL No. MFCD06202342
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO₃
  • Molecular Weight 167.16
  • Synonym(s) 5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic Acid
  • SMILES O=Cc1[nH]c(c(c1C)C(=O)O)C

Synthesis

  • Route1

    References

    • Lv, Kai; Wang, Li-Li; Liu, Ming-Liang; Zhou, Xin-Bo; Fan, Shi-Yong; Liu, Hong-Ying; Zheng, Zhi-Bing; Li, Song Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 10 p. 3062 - 3065
  • Route2
    • null|null
      37059-18-0
    • ~94%
    • In-stock
      5-Formyl-2,4-dimethylpyrrole-3-carboxylic acid|CS-W003265
      253870-02-9

    References

    • Rastogi, Soumya; Marchal, Estelle; Uddin, Imam; Groves, Brandon; Colpitts, Julie; McFarland, Sherri A.; Davis, Jeffery T.; Thompson, Alison Organic and Biomolecular Chemistry, 2013 , vol. 11, # 23 p. 3834 - 3845
  • Route3
    • 2-(tert-Butyl) 4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate|CS-0100009
      86770-31-2
    • ~%
    • In-stock
      5-Formyl-2,4-dimethylpyrrole-3-carboxylic acid|CS-W003265
      253870-02-9

    References

    • Journal of Medicinal Chemistry, , vol. 46, # 7 p. 1116 - 1119

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

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Computational Chemistry Data

  • TPSA   70.16
  • LogP   1.14224
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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