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CS-W001157 4
Total: USD 88.00

2,2-Dimethyl-5-phenyl-1,3-dioxolan-4-one

  • CAS No. 6337-34-4

  • Cat. No. CS-0326767
  • Molecule weight192.21
  • Purity≥98%
  • MDL No.None

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

2,2-Dimethyl-5-phenyl-1,3-dioxolan-4-one|CS-0326767

Structure of 6337-34-4

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General Information

  • CAS No. 6337-34-4
  • Cat. No. CS-0326767
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₂O₃
  • Molecular Weight 192.21
  • Synonym(s) None
  • SMILES CC1(C)OC(C2=CC=CC=C2)C(=O)O1

Synthesis

  • Route1
    • (R)-2-Hydroxy-2-phenylacetic acid  Pregabalin Impurity|CS-0167074
      611-71-2
    • null|null
      67-64-1
    • ~94%
    • 2,2-Dimethyl-5-phenyl-1,3-dioxolan-4-one|CS-0326767
      6337-34-4

    References

    • Cavelier; Gomez; Jacquier; Verducci Tetrahedron Asymmetry, 1993 , vol. 4, # 12 p. 2501 - 2505
  • Route2

    References

    • BOEHRINGER INGELHEIM PHARMA GMBH and CO. KG Patent: US2010/305146 A1, 2010 ; Location in patent: Page/Page column 10-11 ;
  • Route3
    • (R)-2-Hydroxy-2-phenylacetic acid  Pregabalin Impurity|CS-0167074
      611-71-2
    • null|null
      77-76-9
    • ~99%
    • 2,2-Dimethyl-5-phenyl-1,3-dioxolan-4-one|CS-0326767
      6337-34-4

    References

    • Visser, Ton J.; Van Waarde, Aren; Jansen, Twan J. H.; Visser, Gerben M.; Van Der Mark, Thom W.; Kraan, Jan; Ensing, Kees; Vaalburg, Willem Journal of Medicinal Chemistry, 1997 , vol. 40, # 1 p. 117 - 124

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   2.0372
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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