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CS-W001157 4
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6-Amino-2,3-dihydro-1H-isoindol-1-one

  • CAS No. 675109-45-2

  • Cat. No. CS-W022439
  • Purity≥95%
  • MDL No.MFCD09701282

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

6-Amino-2,3-dihydro-1H-isoindol-1-one|CS-W022439

Structure of 675109-45-2

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General Information

  • CAS No. 675109-45-2
  • Cat. No. CS-W022439
  • Purity ≥95%
  • MDL No. MFCD09701282
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈N₂O
  • Molecular Weight 148.16
  • Synonym(s) 6-aminoisoindolin-1-one
  • SMILES O=C1NCC2=C1C=C(N)C=C2

Description

6-Amino-2,3-dihydro-1H-isoindol-1-one features a fused heterocyclic core with a primary amine at the 6-position, enabling direct functionalization in synthetic routes. The isoindolone scaffold provides rigidity and electron-rich character, supporting applications in pharmaceutical intermediates and bioactive molecule design. This bench-stable compound integrates readily into multi-step syntheses under standard conditions.

Application

6-Amino-2,3-dihydro-1H-isoindol-1-one serves as a versatile scaffold in medicinal chemistry, enabling the synthesis of bioactive heterocycles through straightforward functionalization at the amino and carbonyl sites. Its bench-stable nature and compatibility with standard coupling reactions facilitate efficient derivatization for drug discovery applications.

Synthesis

  • Route1

    References

    • BRISTOL-MYERS SQUIBB COMPANY Patent: WO2008/79836 A2, 2008 ; Location in patent: Page/Page column 87 ; WO 2008/079836 A2
  • Route2
    • null|null
      5415-18-9
    • ~%
    • In-stock
      6-Amino-2,3-dihydro-1H-isoindol-1-one|CS-W022439
      675109-45-2

    References

    • Chemische Berichte, , vol. 67, p. 675,681
  • Route3
    • null|null
      3006-64-2
    • ~%
    • In-stock
      6-Amino-2,3-dihydro-1H-isoindol-1-one|CS-W022439
      675109-45-2

    References

    • Chemische Berichte, , vol. 67, p. 675,681

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   55.12
  • LogP   0.5122
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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