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CS-W001157 4
Total: USD 88.00

6-Hydroxyisoindolin-1-one

  • CAS No. 659737-57-2

  • Cat. No. CS-W022503
  • Purity≥97%
  • MDL No.MFCD08276013

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

6-Hydroxyisoindolin-1-one|CS-W022503

Structure of 659737-57-2

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General Information

  • CAS No. 659737-57-2
  • Cat. No. CS-W022503
  • Purity ≥97%
  • MDL No. MFCD08276013
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇NO₂
  • Molecular Weight 149.15
  • Synonym(s) 1H-Isoindol-1-one, 2,3-dihydro-6-hydroxy- (9CI)
  • SMILES O=C1NCC2=C1C=C(O)C=C2

Description

6-Hydroxyisoindolin-1-one delivers a reactive hydroxyl group positioned adjacent to a carbonyl within a stable isoindolinone scaffold. This structural motif enables direct functionalization in synthetic transformations and serves as a key intermediate in bioactive molecule development. The compound exhibits favorable solubility and stability under standard conditions, facilitating integration into diverse reaction sequences.

Application

6-Hydroxyisoindolin-1-one serves as a versatile scaffold for medicinal chemistry and materials synthesis, enabling direct derivatization at the hydroxyl group via esterification or etherification. Its amide functionality supports orthogonal reactivity, while the rigid bicyclic core enhances metabolic stability in bioactive molecule design. Bench-stable and readily purified by recrystallization, it functions as a reliable building block in multi-step syntheses of heterocyclic APIs and functional polymers.

Synthesis

  • Route1

    References

    • F. HOFFMANN-LA ROCHE AG Patent: WO2004/14856 A1, 2004 ; Location in patent: Page 10; 23 ;

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-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   49.33
  • LogP   0.6356
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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