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Ethyl 5-methyl-1H-pyrrole-2-carboxylate

  • CAS No. 3284-51-3

  • Cat. No. CS-D1590
  • Purity≥98%
  • MDL No.MFCD01006731

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

Ethyl 5-methyl-1H-pyrrole-2-carboxylate|CS-D1590

Structure of 3284-51-3

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General Information

  • CAS No. 3284-51-3
  • Cat. No. CS-D1590
  • Purity ≥98%
  • MDL No. MFCD01006731
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₁NO₂
  • Molecular Weight 153.18
  • Synonym(s) 5-Methyl-1H-pyrrole-2-carboxylic acid ethyl ester; Ethyl 5-methyl-1H-pyrrole-2-carboxylate; Ethyl 5-methylpyrrole-2-carboxylate; NSC 81362; 5-Methyl-1H-pyrrole-2-carboxylic acidethyl ester
  • SMILES O=C(C1=CC=C(C)N1)OCC

Description

Ethyl 5-methyl-1H-pyrrole-2-carboxylate features a bench-stable pyrrole core with a methyl group at the 5-position and an ester-functionalized C2. This electron-rich heterocycle integrates readily into synthetic sequences requiring polar, aromatic scaffolds. The ester moiety enables downstream derivatization via hydrolysis or nucleophilic substitution.

Application

Ethyl 5-methyl-1H-pyrrole-2-carboxylate serves as a versatile heterocyclic building block in synthetic organic chemistry, enabling efficient access to substituted pyrroles via standard functional group manipulations. Its methyl and ester groups offer orthogonal reactivity for further derivatization, while the inherent stability facilitates handling and purification. This compound functions effectively in transition-metal-catalyzed couplings and serves as a key intermediate in the synthesis of biologically relevant scaffolds.

Safety Information

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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   42.09
  • LogP   1.49982
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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