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CS-W001157 4
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4-Benzyl-4-methyl-5-methylene-1,3-dioxolan-2-one

  • CAS No. 696650-04-1

  • Cat. No. CS-0322608
  • Molecule weight204.22
  • Purity≥98%
  • MDL No.None

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

4-Benzyl-4-methyl-5-methylene-1,3-dioxolan-2-one|CS-0322608

Structure of 696650-04-1

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General Information

  • CAS No. 696650-04-1
  • Cat. No. CS-0322608
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₂O₃
  • Molecular Weight 204.22
  • Synonym(s) 4-Benzyl-4-methyl-5-methylidene-1,3-dioxolan-2-one
  • SMILES O=C(OC1(C)CC2=CC=CC=C2)OC1=C

Synthesis

  • Route1
    • null|null
      124-38-9
    • 2-Methyl-1-phenylbut-3-yn-2-ol|CS-0966677
      55373-74-5
    • ~77%
    • 4-Benzyl-4-methyl-5-methylene-1,3-dioxolan-2-one|CS-0322608
      696650-04-1

    References

    • Chudinov; Gashev; Chernysheva; Semenov Russian Chemical Bulletin, 2006 , vol. 55, # 1 p. 123 - 136
  • Route2
    • null|null
      103-79-7
    • ~%
    • 4-Benzyl-4-methyl-5-methylene-1,3-dioxolan-2-one|CS-0322608
      696650-04-1

    References

    • Chudinov; Gashev; Chernysheva; Semenov Russian Chemical Bulletin, 2006 , vol. 55, # 1 p. 123 - 136

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   2.6683
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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