Cas no 56153-32-3 (Ethyl 1-methylquinolin-1-ium-4-carboxylate;iodide)

Ethyl 1-methylquinolin-1-ium-4-carboxylate;iodide structure
56153-32-3 structure
Product Name:Ethyl 1-methylquinolin-1-ium-4-carboxylate;iodide
CAS No:56153-32-3
MF:C13H14INO2
MW:343.160235881805
CID:944978
PubChem ID:24192349
Update Time:2025-04-19

Ethyl 1-methylquinolin-1-ium-4-carboxylate;iodide Chemical and Physical Properties

Names and Identifiers

    • ethyl 1-methylquinolin-1-ium-4-carboxylate,iodide
    • 4-Aethoxycarbonyl-1-methyl-chinolinium, Jodid
    • 4-ethoxycarbonyl-1-methyl-quinolinium, iodide
    • Ethyl 1-methylquinolin-1-ium-4-carboxylate
    • iodide
    • NSC138312
    • ethyl 1-methylquinolin-1-ium-4-carboxylate;iodide
    • DS-010958
    • ethyl 1-methyl-8aH-quinoline-4-carboxylate
    • 4-(Ethoxycarbonyl)-1-methylquinolin-1-ium iodide
    • DTXSID80638168
    • starbld0007379
    • NSC-138312
    • 56153-32-3
    • Ethyl 1-methylquinolin-1-ium-4-carboxylate;iodide
    • Inchi: 1S/C13H14NO2.HI/c1-3-16-13(15)11-8-9-14(2)12-7-5-4-6-10(11)12;/h4-9H,3H2,1-2H3;1H/q+1;/p-1
    • InChI Key: ISOWGMALYGPRPU-UHFFFAOYSA-M
    • SMILES: [I-].O(CC)C(C1C=C[N+](C)=C2C=CC=CC2=1)=O

Computed Properties

  • Exact Mass: 217.11035
  • Monoisotopic Mass: 343.00693g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 254
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 30.2?2

Experimental Properties

  • PSA: 29.54
  • LogP: -1.15500

Ethyl 1-methylquinolin-1-ium-4-carboxylate;iodide Pricemore >>

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