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CS-W001157 4
Total: USD 88.00

4,4-Dimethylisochromane-1,3-dione

  • CAS No. 31952-55-3

  • Cat. No. CS-0360214
  • Purity≥95%
  • MDL No.None

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

4,4-Dimethylisochromane-1,3-dione|CS-0360214

Structure of 31952-55-3

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General Information

  • CAS No. 31952-55-3
  • Cat. No. CS-0360214
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀O₃
  • Molecular Weight 190.20
  • Synonym(s) 4,4-Dimethylisochroman-1,3-dione
  • SMILES CC1(C)C2=CC=CC=C2C(=O)OC1=O

Synthesis

  • Route1
    • In-stock
      2-Methyl-2-phenylpropanoic acid|CS-W004146
      826-55-1
    • null|null
      201230-82-2
    • ~30%
    • null|null
      40484-15-9
    • 4,4-Dimethylisochromane-1,3-dione|CS-0360214
      31952-55-3

    References

    • Giri, Ramesh; Yu, Jin-Quan Journal of the American Chemical Society, 2008 , vol. 130, # 43 p. 14082 - 14083
  • Route2
    • null|null
      91496-41-2
    • ~77%
    • 4,4-Dimethylisochromane-1,3-dione|CS-0360214
      31952-55-3

    References

    • Giovannini, Edgardo; Hengartner, Urs; Pasquier, Pierre Helvetica Chimica Acta, 2002 , vol. 85, # 6 p. 1841 - 1849
  • Route3
    • null|null
      40484-15-9
    • ~%
    • 4,4-Dimethylisochromane-1,3-dione|CS-0360214
      31952-55-3

    References

    • Hillery, Paul S.; Cohen, Louis A. Journal of the American Chemical Society, 1983 , vol. 105, # 9 p. 2760 - 2770

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   43.37
  • LogP   1.6612
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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