Cas no 88061-85-2 (3-Nitro-imidazo1,2-apyridine-5-carboxylic Acid methyl ester)

3-Nitro-imidazo[1,2-a]pyridine-5-carboxylic acid methyl ester is a nitro-substituted heterocyclic compound with a fused imidazo[1,2-a]pyridine core. The presence of both a nitro group and a methyl ester functionality enhances its reactivity, making it a versatile intermediate in organic synthesis and medicinal chemistry. Its structural features are particularly valuable for constructing pharmacologically active molecules, including potential antimicrobial and antitumor agents. The electron-withdrawing nitro group facilitates further functionalization, while the ester moiety allows for straightforward derivatization. This compound is typically used in research settings for the development of novel heterocyclic scaffolds. High purity and well-defined synthetic pathways ensure reproducibility in experimental applications.
3-Nitro-imidazo1,2-apyridine-5-carboxylic Acid methyl ester structure
88061-85-2 structure
Product Name:3-Nitro-imidazo1,2-apyridine-5-carboxylic Acid methyl ester
CAS No:88061-85-2
MF:C9H7N3O4
MW:221.169581651688
CID:646856
PubChem ID:13045348
Update Time:2025-05-28

3-Nitro-imidazo1,2-apyridine-5-carboxylic Acid methyl ester Chemical and Physical Properties

Names and Identifiers

    • Imidazo[1,2-a]pyridine-5-carboxylic acid, 3-nitro-, methyl ester
    • 3-Nitro-imidazo[1,2-a]pyridine-5-carboxylic acid methyl ester
    • methyl 3-nitroimidazo[1,2-a]pyridine-5-carboxylate
    • methyl 3-nitroimidazo<1,2-a>pyridine-5-carboxylate
    • 3-Nitroimidazo[1,2-a]pyridine-5-carboxylic acid methyl ester
    • DTXSID00516156
    • G10954
    • 88061-85-2
    • 3-Nitro-imidazo1,2-apyridine-5-carboxylic Acid methyl ester
    • Inchi: 1S/C9H7N3O4/c1-16-9(13)6-3-2-4-7-10-5-8(11(6)7)12(14)15/h2-5H,1H3
    • InChI Key: RUSMBZYHBWYKKQ-UHFFFAOYSA-N
    • SMILES: O(C)C(C1=CC=CC2=NC=C([N+](=O)[O-])N21)=O

Computed Properties

  • Exact Mass: 221.04400
  • Monoisotopic Mass: 221.04365571g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 304
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.1
  • Topological Polar Surface Area: 89.4?2

Experimental Properties

  • PSA: 89.42000
  • LogP: 1.55230

3-Nitro-imidazo1,2-apyridine-5-carboxylic Acid methyl ester Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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