Cas no 4627-24-1 (4H-Quinolizine-1,2-dicarboxylic acid, 4-oxo-, dimethyl ester)

4H-Quinolizine-1,2-dicarboxylic acid, 4-oxo-, dimethyl ester structure
4627-24-1 structure
Product Name:4H-Quinolizine-1,2-dicarboxylic acid, 4-oxo-, dimethyl ester
CAS No:4627-24-1
MF:C13H11NO5
MW:261.230143785477
CID:1517395
Update Time:2024-08-24

4H-Quinolizine-1,2-dicarboxylic acid, 4-oxo-, dimethyl ester Chemical and Physical Properties

Names and Identifiers

    • 4H-Quinolizine-1,2-dicarboxylic acid, 4-oxo-, dimethyl ester
    • 4H-Quinolizine-1,2-dicarboxylic acid, 4-oxo-, 1,2-dimethyl ester
    • Inchi: 1S/C13H11NO5/c1-18-12(16)8-7-10(15)14-6-4-3-5-9(14)11(8)13(17)19-2/h3-7H,1-2H3
    • InChI Key: KLPBMBBXVHRQNG-UHFFFAOYSA-N
    • SMILES: C1(C(OC)=O)=C2N(C=CC=C2)C(=O)C=C1C(OC)=O

Computed Properties

  • Exact Mass: 261.06373

Experimental Properties

  • Density: 1.38±0.1 g/cm3(Predicted)
  • Melting Point: 115 °C(Solv: acetone (67-64-1); ethyl ether (60-29-7))
  • Boiling Point: 426.1±45.0 °C(Predicted)
  • PSA: 72.91
  • pka: -4.08±0.60(Predicted)
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