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3-Hydroxy-1-methyl-3-(2-oxopropyl)indolin-2-one

  • CAS No. 76325-64-9

  • Cat. No. CS-0550063
  • Purity≥98%
  • MDL No.None

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

3-Hydroxy-1-methyl-3-(2-oxopropyl)indolin-2-one|CS-0550063

Structure of 76325-64-9

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General Information

  • CAS No. 76325-64-9
  • Cat. No. CS-0550063
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃NO₃
  • Molecular Weight 219.24
  • Synonym(s) 3-hydroxy-1-methyl-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one
  • SMILES CC(=O)CC1(C2=CC=CC=C2N(C1=O)C)O

Synthesis

  • Route1

    References

    • Malkov, Andrei V.; Kabeshov, Mikhail A.; Bella, Marco; Kysilka, Ondrej; Malyshev, Denis A.; Pluhackova, Kristyna; Kocovsky, Pavel Organic Letters, 2007 , vol. 9, # 26 p. 5473 - 5476
  • Route2

    References

    • Popp; Parson; Donigan Journal of Pharmaceutical Sciences, 1980 , vol. 69, # 10 p. 1235 - 1237
  • Route3

    References

    • Majumdar, Krishna C.; Kundu, Anup K.; Chatterjee, Pranab Journal of Chemical Research, Synopses, 1996 , # 10 p. 460 - 461

Safety Information

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GHS Pictogram : N/A
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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   57.61
  • LogP   0.8297
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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