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CS-W001157 4
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1-(Pyrrolidin-1-yl)prop-2-yn-1-one

  • CAS No. 82038-67-3

  • Cat. No. CS-0070955
  • Purity≥97%
  • MDL No.MFCD20528145

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

1-(Pyrrolidin-1-yl)prop-2-yn-1-one|CS-0070955

Structure of 82038-67-3

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General Information

  • CAS No. 82038-67-3
  • Cat. No. CS-0070955
  • Purity ≥97%
  • MDL No. MFCD20528145
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉NO
  • Molecular Weight 123.15
  • Synonym(s) Pyrrolidine, 1-(1-oxo-2-propynyl)- (9CI)
  • SMILES C#CC(N1CCCC1)=O

Synthesis

  • Route1
    • null|null
      123-75-1
    • null|null
      922-67-8
    • ~97%
    • 1-(Pyrrolidin-1-yl)prop-2-yn-1-one|CS-0070955
      82038-67-3

    References

    • UCB PHARMA S.A. Patent: WO2007/141504 A1, 2007 ; Location in patent: Page/Page column 65-66 ; WO 2007/141504 A1
  • Route2
    • null|null
      123-75-1
    • null|null
      623-47-2
    • ~70%
    • 1-(Pyrrolidin-1-yl)prop-2-yn-1-one|CS-0070955
      82038-67-3

    References

    • Williamson, Bobby L.; Tykwinski, Rik R.; Stang, Peter J. Journal of the American Chemical Society, 1994 , vol. 116, # 1 p. 93 - 98

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

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Computational Chemistry Data

  • TPSA   20.31
  • LogP   0.242
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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