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CS-W001157 4
Total: USD 88.00

1-(Indolin-1-yl)propan-1-one

  • CAS No. 56857-92-2

  • Cat. No. CS-0363687
  • Purity≥98%
  • MDL No.None

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

1-(Indolin-1-yl)propan-1-one|CS-0363687

Structure of 56857-92-2

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General Information

  • CAS No. 56857-92-2
  • Cat. No. CS-0363687
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO
  • Molecular Weight 175.23
  • Synonym(s) 1H-Indole, 2,3-dihydro-1-(1-oxopropyl)-
  • SMILES CCC(N1CCC2=C1C=CC=C2)=O

Synthesis

  • Route1

    References

    • THE BROAD INSTITUTE, INC.; MASSACHUSETTS INSTITUTE OF TECHNOLOGY; DOCKENDORFF, Chris; YOUNGSAYE, Willmen; NAG, Partha Pratim; LEWIS, Timothy A.; DANDAPANI, Sivaraman; MUNOZ, Benito; FALLOON, Patrick; NIELAND, Thomas; KRIEGER, Monty; YU, Miao Patent: WO2014/63167 A1, 2014 ; Location in patent: Page/Page column 21 ;
  • Route2
    • null|null
      1297604-92-2
    • ~78%
    • 1-(Indolin-1-yl)propan-1-one|CS-0363687
      56857-92-2

    References

    • Li, Wen-Jing; Zhao, Fen-Fen; Ding, Ming-Wu Synlett, 2011 , # 2 art. no. W15110ST, p. 265 - 267

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   20.31
  • LogP   1.9857
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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