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CS-W001157 4
Total: USD 88.00

3-Methylbenzofuran

  • CAS No. 21535-97-7

  • Cat. No. CS-0006837
  • Purity≥98%
  • MDL No.MFCD00205641

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

3-Methylbenzofuran|CS-0006837

Structure of 21535-97-7

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General Information

  • CAS No. 21535-97-7
  • Cat. No. CS-0006837
  • Purity ≥98%
  • MDL No. MFCD00205641
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈O
  • Molecular Weight 132.16
  • Synonym(s) None
  • SMILES O1C=C(C=2C=CC=CC12)C

Description

3-Methyl-1-benzofuran is a heterocyclic aromatic compound featuring a fused benzene and furan ring system with a methyl group at the 3-position. This configuration imparts enhanced electron density and stability, enabling its use as a key scaffold in medicinal chemistry and materials science. The compound exhibits favorable solubility in organic solvents and maintains integrity under standard bench conditions.

Application

3-Methyl-1-benzofuran serves as a versatile heterocyclic building block in synthetic organic chemistry, enabling efficient access to bioactive scaffolds. Its electron-rich aromatic system facilitates electrophilic substitution and transition-metal-catalyzed coupling reactions. The methyl group enhances metabolic stability and provides a handle for further functionalization, while the benzofuran core offers favorable physicochemical properties for medicinal chemistry applications. Bench-stable and readily purified by column chromatography, it functions reliably in multi-step syntheses.

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1760
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H318
Precautionary Statements : P264-P270-P280-P330-P501

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Computational Chemistry Data

  • TPSA   13.14
  • LogP   2.74122
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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