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CS-W001157 4
Total: USD 88.00

2-(4,4-Dimethoxybutan-2-ylidene)malononitrile

  • CAS No. 410547-37-4

  • Cat. No. CS-0465477
  • Molecule weight180.20
  • Purity≥98%
  • MDL No.None

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

2-(4,4-Dimethoxybutan-2-ylidene)malononitrile|CS-0465477

Structure of 410547-37-4

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General Information

  • CAS No. 410547-37-4
  • Cat. No. CS-0465477
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂N₂O₂
  • Molecular Weight 180.20
  • Synonym(s) 4,4-Dicyano-3-methyl-3-butenal dimethyl acetal
  • SMILES CC(=C(C#N)C#N)CC(OC)OC

Synthesis

  • Route1
    • In-stock
      4,4-Dimethoxy-2-butanone|CS-0008327
      5436-21-5
    • null|null
      109-77-3
    • ~%
    • null|null
      1025080-30-1
    • 2-(4,4-Dimethoxybutan-2-ylidene)malononitrile|CS-0465477
      410547-37-4

    References

    • LG LIFE SCIENCES LTD. Patent: WO2008/56898 A1, 2008 ; Location in patent: Page/Page column 14 ; WO 2008/056898 A1
  • Route2
    • In-stock
      4,4-Dimethoxy-2-butanone|CS-0008327
      5436-21-5
    • null|null
      109-77-3
    • ~%
    • null|null
      410547-38-5
    • 2-(4,4-Dimethoxybutan-2-ylidene)malononitrile|CS-0465477
      410547-37-4

    References

    • ISHIHARA SANGYO KAISHA, LTD. Patent: EP1679003 A1, 2006 ; Location in patent: Page/Page column 21 ;
  • Route3

    References

    • Chan, David C. M.; Rosowsky, Andre Journal of Organic Chemistry, 2005 , vol. 70, # 4 p. 1364 - 1368

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   66.04
  • LogP   1.35906
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   4

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