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CS-W001157 4
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3-Methylpyrrole

  • CAS No. 616-43-3

  • Cat. No. CS-W016682
  • Purity≥95%
  • MDL No.MFCD00083419

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

3-Methylpyrrole|CS-W016682

Structure of 616-43-3

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General Information

  • CAS No. 616-43-3
  • Cat. No. CS-W016682
  • Purity ≥95%
  • MDL No. MFCD00083419
  • Storage -20°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₇N
  • Molecular Weight 81.12
  • Synonym(s) None
  • SMILES CC1=CNC=C1

Description

3-Methyl-1H-pyrrole is a heterocyclic compound featuring a nitrogen-containing five-membered ring with a methyl substituent at the 3-position. This electron-rich structure enhances reactivity in transition metal-catalyzed couplings and serves as a key scaffold in bioactive molecule synthesis. The molecule exhibits favorable solubility in common organic solvents and maintains stability under standard bench conditions.

Application

3-Methyl-1H-pyrrole serves as a versatile building block in synthetic organic chemistry, enabling access to substituted pyrroles via electrophilic substitution and transition-metal-catalyzed coupling reactions. Its methyl group enhances regioselectivity in functionalization and improves bench stability compared to unsubstituted analogs. The compound functions effectively in the synthesis of heterocyclic scaffolds relevant to medicinal chemistry and agrochemical development.

Synthesis

  • Route1

    References

    • Garrido, Daniel O. A.; Buldain, Graciela; Ojea, Maria I.; Frydman, Benjamin Journal of Organic Chemistry, 1988 , vol. 53, # 2 p. 403 - 407
  • Route2

    References

    • Garrido, Daniel O. A.; Buldain, Graciela; Ojea, Maria I.; Frydman, Benjamin Journal of Organic Chemistry, 1988 , vol. 53, # 2 p. 403 - 407
  • Route3
    • null|null
      41282-40-0
    • null|null
      201230-82-2
    • ~10%
    • In-stock
      3-Methylpyrrole|CS-W016682
      616-43-3
    • null|null
      1575-46-8

    References

    • Australian Journal of Chemistry, , vol. 45, # 7 p. 1167 - 1178

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   15.79
  • LogP   1.32312
  • H_Acceptors   0
  • H_Donors   1
  • Rotatable_Bonds   0

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