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CS-W001157 4
Total: USD 88.00

Dimethadione

  • CAS No. 695-53-4

  • Cat. No. CS-0013093
  • Purity≥97%
  • MDL No.MFCD00005379

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

Dimethadione|CS-0013093

Structure of 695-53-4

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General Information

  • CAS No. 695-53-4
  • Cat. No. CS-0013093
  • Purity ≥97%
  • MDL No. MFCD00005379
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₇NO₃
  • Molecular Weight 129.11
  • Synonym(s) None
  • SMILES O=C(N1)OC(C)(C)C1=O

Synthesis

  • Route1
    • null|null
      80-55-7
    • null|null
      3019-71-4
    • ~72%
    • In-stock
      Dimethadione|CS-0013093
      695-53-4

    References

    • Li, Yue H.; Zhang, Li; Tseng, Pei-San; Zhang, Yongliang; Jin, Yu; Shen, Jingkang; Jin, Jian Tetrahedron Letters, 2009 , vol. 50, # 7 p. 790 - 792
  • Route2

    References

    • Journal of the American Chemical Society, , vol. 63, p. 2376,2378 Acta Academiae Aboensis, Series B: Mathematica et Physica, , vol. 11, # 14 p. 3,7 Chem. Zentralbl., , vol. 110, # II p. 3092
  • Route3
    • null|null
      26212-62-4
    • ~%
    • In-stock
      Dimethadione|CS-0013093
      695-53-4

    References

    • Journal of Organic Chemistry, , vol. 35, p. 4244 - 4245

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS08
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302+H312+H332-H351
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.4
  • LogP   0.0314
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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