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CS-W001157 4
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3,3-Dimethyl-1-(piperazin-1-yl)butan-1-one

  • CAS No. 253175-46-1

  • Cat. No. CS-0124439
  • Purity≥98%
  • MDL No.MFCD08444700

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

3,3-Dimethyl-1-(piperazin-1-yl)butan-1-one|CS-0124439

Structure of 253175-46-1

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General Information

  • CAS No. 253175-46-1
  • Cat. No. CS-0124439
  • Purity ≥98%
  • MDL No. MFCD08444700
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₂₀N₂O
  • Molecular Weight 184.28
  • Synonym(s) Piperazine, 1-(3,3-dimethyl-1-oxobutyl)- (9CI)
  • SMILES CC(C)(C)CC(N1CCNCC1)=O

Synthesis

  • Route1
    • null|null
      253175-45-0
    • ~%
    • 3,3-Dimethyl-1-(piperazin-1-yl)butan-1-one|CS-0124439
      253175-46-1

    References

    • Bristol-Myers Squibb Co. Patent: US6335324 B1, 2002 ; Location in patent: Page column 64 ; US 6335324 B1
  • Route2
    • null|null
      7065-46-5
    • ~%
    • 3,3-Dimethyl-1-(piperazin-1-yl)butan-1-one|CS-0124439
      253175-46-1

    References

    • Sutton, James C.; Bolton, Scott A.; Hartl, Karen S.; Huang, Ming-Hsing; Jacobs, Glenn; Meng, Wei; Ogletree, Martin L.; Pi, Zulan; Schumacher, William A.; Seiler, Steven M.; Slusarchyk, William A.; Treuner, Uwe; Zahler, Robert; Zhao, Guohua; Bisacchi, Gregory S. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 21 p. 3229 - 3233

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   32.34
  • LogP   0.8544
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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