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CS-W001157 4
Total: USD 88.00

6,7-Dihydro-1H-indol-4(5H)-one

  • CAS No. 13754-86-4

  • Cat. No. CS-0038145
  • Purity≥98%
  • MDL No.None

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

6,7-Dihydro-1H-indol-4(5H)-one|CS-0038145

Structure of 13754-86-4

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General Information

  • CAS No. 13754-86-4
  • Cat. No. CS-0038145
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO
  • Molecular Weight 135.16
  • Synonym(s) 4-Oxo-4,5,6,7-tetrahydroindole
  • SMILES C1CC2=C(C=CN2)C(=O)C1

Description

Iodination of 1,5,6,7-tetrahydro-4H-indol-4-one using 1-chloromethyl-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate) yields -iodo derivative as the main product.1,5,6,7-Tetrahydro-4H-indol-4-one may be used in the preparation of:4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carbonitrilemethyl 2-(4-oxo-4,5,6,7-tetrahydro-1H-indol-1-yl)acrylate3-(4-oxo-4,5,6,7-tetrahydro-1H-indol-1-yl)propanenitrilepotent and orally active 5-HT1A agonists, (R)-(+)- and (S)-(-)-1-formyl-6,7,8,9-tetrahydro-N,N-dipropyl-3H-benz[e]indol-8-amines

Synthesis

  • Route1

    References

    • Matsumoto, Masakatsu; Watanabe, Nobuko Heterocycles, 1984 , vol. 22, # 10 p. 2313 - 2316
  • Route2
    • null|null
      392232-66-5
    • ~89%
    • In-stock
      6,7-Dihydro-1H-indol-4(5H)-one|CS-0038145
      13754-86-4

    References

    • Lipshutz, Bruce H.; Pfeiffer, Steven S.; Reed, Anthony B. Organic Letters, 2001 , vol. 3, # 26 p. 4145 - 4148
  • Route3
    • null|null
      76327-74-7
    • null|null
      76327-75-8
    • ~49%
    • In-stock
      6,7-Dihydro-1H-indol-4(5H)-one|CS-0038145
      13754-86-4

    References

    • Kuraray Co., Ltd. Patent: US4336202 A1, 1982 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   32.86
  • LogP   1.5337
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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