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CS-W001157 4
Total: USD 88.00

1-(5-Iodoindolin-1-yl)ethan-1-one

  • CAS No. 61995-51-5

  • Cat. No. CS-0551356
  • Purity≥98%
  • MDL No.None

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

1-(5-Iodoindolin-1-yl)ethan-1-one|CS-0551356

Structure of 61995-51-5

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General Information

  • CAS No. 61995-51-5
  • Cat. No. CS-0551356
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀INO
  • Molecular Weight 287.10
  • Synonym(s) 1-Acetyl-5-iodoindoline
  • SMILES CC(=O)N1CCC2=C1C=CC(=C2)I

Synthesis

  • Route1

    References

    • ASTRAZENECA AB; ASTEX THERAPEUTICS LTD Patent: WO2007/58602 A2, 2007 ; Location in patent: Page/Page column 121-122 ; WO 2007/058602 A2
  • Route2

    References

    • Kalyani, Dipannita; Dick, Allison R.; Anani, Waseem Q.; Sanford, Melanie S. Tetrahedron, 2006 , vol. 62, # 49 p. 11483 - 11498
  • Route3

    References

    • Somei, Masanori; Saida, Yoshihiro Heterocycles, 1985 , vol. 23, # 12 p. 3113 - 3114

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   2.2002
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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