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CS-W001157 4
Total: USD 88.00

Ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate

  • CAS No. 2199-44-2

  • Cat. No. CS-D1225
  • Molecule weight167.21
  • Purity≥98%
  • MDL No.MFCD00010645

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

Ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-D1225

Structure of 2199-44-2

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General Information

  • CAS No. 2199-44-2
  • Cat. No. CS-D1225
  • Purity ≥98%
  • MDL No. MFCD00010645
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₃NO₂
  • Molecular Weight 167.21
  • Synonym(s) NSC 10763; Pyrrole-2-Carboxylic Acid, 3,5-Dimethyl-,Ethyl Ester
  • SMILES O=C(C1=C(C)C=C(C)N1)OCC

Synthesis

  • Route1
    • Diethyl 2-(hydroxyimino)malonate|CS-0132351
      6829-41-0
    • null|null
      123-54-6
    • ~82%
    • In-stock
      Ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-D1225
      2199-44-2

    References

    • Huggins, Michael T.; Salzameda, Nicholas T.; Lightner, David A. Supramolecular Chemistry, 2011 , vol. 23, # 3-4 p. 226 - 238
  • Route2
    • Ethyl 4-acetyl-3,5-dimethyl-1h-pyrrole-2-carboxylate|CS-0298816
      2386-26-7
    • ~99%
    • In-stock
      Ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-D1225
      2199-44-2

    References

    • Moon, M. W.; Wade, R. A. Journal of Organic Chemistry, 1984 , vol. 49, # 15 p. 2663 - 2669
  • Route3
    • null|null
      105-56-6
    • null|null
      123-54-6
    • ~82%
    • In-stock
      Ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-D1225
      2199-44-2

    References

    • Takaya, Hikaru; Kojima, Sachiko; Murahashi, Shun-Ichi Organic Letters, 2001 , vol. 3, # 3 p. 421 - 424

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   42.09
  • LogP   1.80824
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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