Cas no 916226-83-0 (Methyl 4-Hydroxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate)

Methyl 4-Hydroxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate is a pyridine derivative with notable applications in pharmaceutical and organic synthesis. Its structure features a carboxylate ester and hydroxyl group, making it a versatile intermediate for constructing heterocyclic compounds. The compound's stability under standard conditions and well-defined reactivity profile enhance its utility in medicinal chemistry, particularly in the development of bioactive molecules. Its crystalline form ensures consistent purity, facilitating precise synthetic workflows. The presence of both electron-donating and electron-withdrawing substituents allows for selective functionalization, enabling tailored modifications for target-oriented synthesis. Suitable for research-scale and industrial applications, it offers reliable performance in complex reaction schemes.
Methyl 4-Hydroxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate structure
916226-83-0 structure
Product Name:Methyl 4-Hydroxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate
CAS No:916226-83-0
MF:C8H9NO4
MW:183.161362409592
MDL:MFCD27986809
CID:786895
PubChem ID:57619583
Update Time:2025-05-26

Methyl 4-Hydroxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-Hydroxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate
    • AC7243
    • WGVJBUNCLUARHW-UHFFFAOYSA-N
    • SCHEMBL1400324
    • 916226-83-0
    • EN300-8309351
    • Methyl4-Hydroxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate
    • A915418
    • SY028758
    • AKOS027257068
    • MFCD27986809
    • MDL： MFCD27986809
    • Inchi： 1S/C8H9NO4/c1-9-4-3-5(10)6(7(9)11)8(12)13-2/h3-4,10H,1-2H3
    • InChI Key： WGVJBUNCLUARHW-UHFFFAOYSA-N
    • SMILES： OC1C=CN(C)C(C=1C(=O)OC)=O

Computed Properties

  • Exact Mass: 183.05300
  • Monoisotopic Mass: 183.053
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 316
  • 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
  • Topological Polar Surface Area: 66.8A^2
  • XLogP3: 0.4

Experimental Properties

  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 321.0±42.0 °C at 760 mmHg
  • Flash Point: 148.0±27.9 °C
  • PSA: 68.53000
  • LogP: -0.12250
  • Vapor Pressure: 0.0±1.5 mmHg at 25°C

Methyl 4-Hydroxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate Security Information

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Enamine
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Enamine
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Enamine
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