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CS-W001157 4
Total: USD 88.00

3-Ethyl-2-methyl-1,5,6,7-tetrahydro-4h-indol-4-one

  • CAS No. 6116-76-3

  • Cat. No. CS-0172213
  • Molecule weight177.24
  • Purity≥98%
  • MDL No.None

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

3-Ethyl-2-methyl-1,5,6,7-tetrahydro-4h-indol-4-one|CS-0172213

Structure of 6116-76-3

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General Information

  • CAS No. 6116-76-3
  • Cat. No. CS-0172213
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₅NO
  • Molecular Weight 177.24
  • Synonym(s) 3-Ethyl-2-methyl-4,5,6,7-tetrahydroindol-4-one
  • SMILES CCC1=C(C)NC2=C1C(=O)CCC2

Synthesis

  • Route1

    References

    • Masaguer, Christian F.; Casariego, Isabel; Ravina, Enrique Chemical and Pharmaceutical Bulletin, 1999 , vol. 47, # 5 p. 621 - 632
  • Route2
    • null|null
      98263-35-5
    • ~76%
    • 3-Ethyl-2-methyl-1,5,6,7-tetrahydro-4h-indol-4-one|CS-0172213
      6116-76-3

    References

    • Fukada; Trudell; Johnson; Cook Tetrahedron Letters, 1985 , vol. 26, # 18 p. 2139 - 2142
  • Route3

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 16, # 22 p. 5859 - 5863

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

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Computational Chemistry Data

  • TPSA   32.86
  • LogP   2.40452
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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