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CS-W001157 4
Total: USD 88.00

1-Methyl-3-nicotinoylpyrrolidin-2-one

  • CAS No. 125630-28-6

  • Cat. No. CS-0461484
  • Molecule weight204.23
  • Purity≥98%
  • MDL No.None

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

1-Methyl-3-nicotinoylpyrrolidin-2-one|CS-0461484

Structure of 125630-28-6

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General Information

  • CAS No. 125630-28-6
  • Cat. No. CS-0461484
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₂N₂O₂
  • Molecular Weight 204.23
  • Synonym(s) (R,S)-1-Methyl-3-nicotinoylpyrrolidone
  • SMILES CN1CCC(C(=O)C2=CN=CC=C2)C1=O

Synthesis

  • Route1

    References

    • TOPHARMAN SHANGHAI CO., LTD.; TOPHARMAN SHANDONG CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES; Tian, Guanghui; Wang, Guan; Kong, Xiaoguang; Zhang, Rongxia; Chen, Weiming; Shen, Jingshan Patent: US2014/31554 A1, 2014 ; Location in patent: Paragraph 0045; 0046 ;
  • Route2

    References

    • US2014/31554 A1, ;
  • Route3

    References

    • Chemische Berichte, , vol. 61, p. 330

Safety Information

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GHS Pictogram : N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   50.27
  • LogP   0.7426
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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