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CS-W001157 4
Total: USD 88.00

Methyl 3-formyl-4-nitrobenzoate

  • CAS No. 148625-35-8

  • Cat. No. CS-W005134
  • Purity≥95%
  • MDL No.MFCD05664271

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

Methyl 3-formyl-4-nitrobenzoate|CS-W005134

Structure of 148625-35-8

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General Information

  • CAS No. 148625-35-8
  • Cat. No. CS-W005134
  • Purity ≥95%
  • MDL No. MFCD05664271
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₅
  • Molecular Weight None
  • Synonym(s) None
  • SMILES O=C(OC)C1=CC=C([N+]([O-])=O)C(C=O)=C1

Description

Methyl 3-formyl-4-nitrobenzoate features a conjugated system integrating an electron-deficient nitro group and a reactive formyl moiety, enabling direct functionalization in cross-coupling and condensation reactions. This bench-stable reagent facilitates efficient access to complex aromatic scaffolds under standard conditions.

Application

Methyl 3-formyl-4-nitrobenzoate serves as a versatile synthetic building block for the construction of heterocyclic scaffolds and functionalized aromatic systems. The ortho-directed formyl and nitro groups enable sequential transformations, including reductive amination, nucleophilic addition, and cyclization reactions. Its bench-stable nature and compatibility with standard purification methods facilitate integration into multi-step synthesis workflows for medicinal chemistry and materials development.

Safety Information

Download SDS
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   86.51
  • LogP   1.1939
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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