Cas no 52760-99-3 (Piperidinium,4-(ethoxycarbonyl)-1,1-dimethyl-, iodide (1:1))

Piperidinium,4-(ethoxycarbonyl)-1,1-dimethyl-, iodide (1:1) structure
52760-99-3 structure
Product Name:Piperidinium,4-(ethoxycarbonyl)-1,1-dimethyl-, iodide (1:1)
CAS No:52760-99-3
MF:C10H20INO2
MW:313.175775527954
CID:367930
PubChem ID:6452722
Update Time:2025-04-19

Piperidinium,4-(ethoxycarbonyl)-1,1-dimethyl-, iodide (1:1) Chemical and Physical Properties

Names and Identifiers

    • Piperidinium,4-(ethoxycarbonyl)-1,1-dimethyl-, iodide (1:1)
    • ethyl 1,1-dimethylpiperidin-1-ium-4-carboxylate,iodide
    • N-methylpethidine
    • N-Methyldemerol
    • N-Methylmeperidine
    • 4-(ETHOXYCARBONYL)-1,1-DIMETHYLPIPERIDIN-1-IUM IODIDE
    • DTXSID20967207
    • 52760-99-3
    • Piperidinium, 4-(ethoxycarbonyl)-1,1-dimethyl-, iodide
    • Inchi: 1S/C10H20NO2.HI/c1-4-13-10(12)9-5-7-11(2,3)8-6-9;/h9H,4-8H2,1-3H3;1H/q+1;/p-1
    • InChI Key: BXEPTAGEPPHUDX-UHFFFAOYSA-M
    • SMILES: [I-].O(CC)C(C1CC[N+](C)(C)CC1)=O

Computed Properties

  • Exact Mass: 292.8969
  • Monoisotopic Mass: 313.053872
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 179
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 26.3

Experimental Properties

  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 26.3

Piperidinium,4-(ethoxycarbonyl)-1,1-dimethyl-, iodide (1:1) Related Literature

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