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CS-W001157 4
Total: USD 88.00

3-Oxoisoindoline-5-carbaldehyde

  • CAS No. 1260664-94-5

  • Cat. No. CS-W005753
  • Purity≥98%
  • MDL No.MFCD18251181

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

3-Oxoisoindoline-5-carbaldehyde|CS-W005753

Structure of 1260664-94-5

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General Information

  • CAS No. 1260664-94-5
  • Cat. No. CS-W005753
  • Purity ≥98%
  • MDL No. MFCD18251181
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₂
  • Molecular Weight 161.16
  • Synonym(s) None
  • SMILES O=CC1=CC=C2C(C(NC2)=O)=C1

Description

3-Oxoisoindoline-5-carbaldehyde features a fused bicyclic core with a ketone and aldehyde functional group in close proximity, enabling direct participation in cascade reactions. This electron-deficient scaffold integrates readily into complex heterocyclic architectures under mild conditions.

Application

3-Oxoisoindoline-5-carbaldehyde serves as a versatile building block in medicinal chemistry, enabling the construction of heterocyclic scaffolds via condensation and cyclization reactions. Its orthogonal functional groups—ketone and aldehyde—facilitate sequential transformations, while its bench-stable nature supports reliable handling and purification in multi-step syntheses.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P260-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   46.17
  • LogP   0.7425
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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