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CS-W001157 4
Total: USD 88.00

Isoindolin-5-ol

  • CAS No. 54544-67-1

  • Cat. No. CS-0055007
  • Purity≥97%
  • MDL No.MFCD11223558

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

Isoindolin-5-ol|CS-0055007

Structure of 54544-67-1

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General Information

  • CAS No. 54544-67-1
  • Cat. No. CS-0055007
  • Purity ≥97%
  • MDL No. MFCD11223558
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO
  • Molecular Weight 135.16
  • Synonym(s) 2,3-dihydro-1H-isoindol-5-ol
  • SMILES OC1=CC2=C(CNC2)C=C1

Synthesis

  • Route1

    References

    • MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG Patent: US2010/256137 A1, 2010 ; Location in patent: Page/Page column 18 ;
  • Route2
    • 2,3-Dihydro-5-methoxy-1H-isoindole|CS-W008864
      127168-88-1
    • ~82%
    • Isoindolin-5-ol|CS-0055007
      54544-67-1

    References

    • Austin, Nigel E; Avenell, Kim Y; Boyfield, Izzy; Branch, Clive L; Hadley, Michael S; Jeffrey, Phillip; Johnson, Christopher N; Macdonald, Gregor J; Nash, David J; Riley, Graham J; Smith, Alexander B; Stemp, Geoffrey; Thewlis, Kevin M; Vong, Antonio K.K; Wood, Martyn D Bioorganic and Medicinal Chemistry Letters, 2001 , vol. 11, # 5 p. 685 - 688

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-H315-H319
Precautionary Statements : P264-P270-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   32.26
  • LogP   0.9954
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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