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1,5,6,7-Tetrahydro-2-methyl-4h-indol-4-one

  • CAS No. 35308-68-0

  • Cat. No. CS-0213125
  • Molecule weight149.19
  • Purity≥98%
  • MDL No.MFCD04972500

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

1,5,6,7-Tetrahydro-2-methyl-4h-indol-4-one|CS-0213125

Structure of 35308-68-0

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General Information

  • CAS No. 35308-68-0
  • Cat. No. CS-0213125
  • Purity ≥98%
  • MDL No. MFCD04972500
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁NO
  • Molecular Weight 149.19
  • Synonym(s) 2-Methyl-4-oxo-4,5,6,7-tetrahydroindole
  • SMILES CC1=CC2=C(CCCC2=O)N1

Synthesis

  • Route1

    References

    • ONO PHARMACEUTICAL CO., LTD. Patent: EP1367050 A1, 2003 ; Location in patent: Page 10 ;
  • Route2
    • null|null
      90534-62-6
    • ~86%
    • 1,5,6,7-Tetrahydro-2-methyl-4h-indol-4-one|CS-0213125
      35308-68-0

    References

    • Barraja, Paola; Diana, Patrizia; Montalbano, Alessandra; Carbone, Anna; Cirrincione, Girolamo; Viola, Giampietro; Salvador, Alessia; Vedaldi, Daniela; Dall'Acqua, Francesco Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 22 p. 9668 - 9683
  • Route3
    • null|null
      458530-50-2
    • ~74%
    • 1,5,6,7-Tetrahydro-2-methyl-4h-indol-4-one|CS-0213125
      35308-68-0

    References

    • ONO PHARMACEUTICAL CO., LTD. Patent: EP1367050 A1, 2003 ; Location in patent: Page 11-12 ;

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-H317
Precautionary Statements : P261-P264-P270-P272-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   32.86
  • LogP   1.84212
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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