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CS-W001157 4
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1,2,3,9-Tetrahydro-9-methyl-4H-carbazole-4-one Ondansetron Impurity

  • CAS No. 27387-31-1

  • Cat. No. CS-0229595
  • Purity≥98%
  • MDL No.MFCD00173748

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

1,2,3,9-Tetrahydro-9-methyl-4H-carbazole-4-one Ondansetron Impurity|CS-0229595

Structure of 27387-31-1

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General Information

  • CAS No. 27387-31-1
  • Cat. No. CS-0229595
  • Purity ≥98%
  • MDL No. MFCD00173748
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₃NO
  • Molecular Weight 199.25
  • Synonym(s) None
  • SMILES O=C1C=2C=3C=CC=CC3N(C2CCC1)C

Synthesis

  • Route1
    • 1,2,3,9-Tetrahydro-4H-carbazol-4-one Ondansetron  Impurity|CS-0228796
      15128-52-6
    • null|null
      74-88-4
    • ~91%
    • 1,2,3,9-Tetrahydro-9-methyl-4H-carbazole-4-one Ondansetron Impurity|CS-0229595
      27387-31-1

    References

    • Gartshore, Christopher J.; Lupton, David W. Australian Journal of Chemistry, 2013 , vol. 66, # 8 p. 882 - 890
  • Route2
    • null|null
      1373402-37-9
    • ~80%
    • 1,2,3,9-Tetrahydro-9-methyl-4H-carbazole-4-one Ondansetron Impurity|CS-0229595
      27387-31-1

    References

    • Ban, Xu; Pan, Yan; Lin, Yingfu; Wang, Songqing; Du, Yunfei; Zhao, Kang Organic and Biomolecular Chemistry, 2012 , vol. 10, # 18 p. 3606 - 3609
  • Route3
    • 1,2,3,9-Tetrahydro-4H-carbazol-4-one Ondansetron  Impurity|CS-0228796
      15128-52-6
    • null|null
      77-78-1
    • ~89%
    • 1,2,3,9-Tetrahydro-9-methyl-4H-carbazole-4-one Ondansetron Impurity|CS-0229595
      27387-31-1

    References

    • Rodriguez, Jose Gonzalo; Valle, Celestina del; Esteban-Calderon, Carmen; Martinez-Ripoll, Martin Journal of Chemical Crystallography, 1995 , vol. 25, # 5 p. 249 - 258

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H412
Precautionary Statements : P264-P270-P273-P330-P405-P501

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Computational Chemistry Data

  • TPSA   22
  • LogP   2.6973
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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