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CS-W001157 4
Total: USD 88.00

7-Methylisobenzofuran-1(3H)-one

  • CAS No. 2211-84-9

  • Cat. No. CS-0318290
  • Purity≥97%
  • MDL No.None

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

7-Methylisobenzofuran-1(3H)-one|CS-0318290

Structure of 2211-84-9

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General Information

  • CAS No. 2211-84-9
  • Cat. No. CS-0318290
  • Purity ≥97%
  • 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) 7-Methyl-3H-isobenzofuran-1-one
  • SMILES CC1=C2C(=CC=C1)COC2=O

Synthesis

  • Route1

    References

    • Novak, Petr; Correa, Arkaitz; Gallardo-Donaire, Joan; Martin, Ruben Angewandte Chemie - International Edition, 2011 , vol. 50, # 51 p. 12236 - 12239
  • Route2
    • null|null
      452978-83-5
    • ~%
    • 7-Methylisobenzofuran-1(3H)-one|CS-0318290
      2211-84-9

    References

    • EP1362856 A1, ; Page/Page column 150 ;
  • Route3
    • null|null
      56263-55-9
    • ~68%
    • 7-Methylisobenzofuran-1(3H)-one|CS-0318290
      2211-84-9

    References

    • Neudeck Monatshefte fur Chemie, 1996 , vol. 127, # 2 p. 201 - 217

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-P330-P362+P364-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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