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CS-W001157 4
Total: USD 88.00

4-Methylisobenzofuran-1(3H)-one

  • CAS No. 2211-83-8

  • Cat. No. CS-0333569
  • Purity95+%
  • MDL No.None

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

4-Methylisobenzofuran-1(3H)-one|CS-0333569

Structure of 2211-83-8

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General Information

  • CAS No. 2211-83-8
  • Cat. No. CS-0333569
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈O₂
  • Molecular Weight 148.16
  • Synonym(s) 4-methyl-2-benzofuran-1(3H)-one
  • SMILES CC1=C2COC(=O)C2=CC=C1

Synthesis

  • Route1

    References

    • Ghosh, Ketaki; Karmakar, Raju; Mal, Dipakranjan European Journal of Organic Chemistry, 2013 , # 19 p. 4037 - 4046
  • Route2
    • 4-(Bromomethyl)isobenzofuran-1(3H)-one|CS-0865966
      177166-14-2
    • ~%
    • 4-Methylisobenzofuran-1(3H)-one|CS-0333569
      2211-83-8

    References

    • Neudeck Monatshefte fur Chemie, 1996 , vol. 127, # 2 p. 201 - 217
  • Route3
    • null|null
      98369-31-4
    • ~70%
    • 4-Methylisobenzofuran-1(3H)-one|CS-0333569
      2211-83-8

    References

    • Noguchi, Michihiko; Kakimoto, Shinji; Kawakami, Hisao; Kajigaeshi, Shoji Heterocycles, 1985 , vol. 23, # 5 p. 1085 - 1088

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

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   1.66542
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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