Cas no 6893-34-1 (2-Pyridineethanaminium,N,N-diethyl-N-methyl-, iodide (1:1))

2-Pyridineethanaminium,N,N-diethyl-N-methyl-, iodide (1:1) structure
6893-34-1 structure
Product Name:2-Pyridineethanaminium,N,N-diethyl-N-methyl-, iodide (1:1)
CAS No:6893-34-1
MF:C12H21IN2
MW:320.213015317917
CID:504635
PubChem ID:3036615
Update Time:2025-04-19

2-Pyridineethanaminium,N,N-diethyl-N-methyl-, iodide (1:1) Chemical and Physical Properties

Names and Identifiers

    • 2-Pyridineethanaminium,N,N-diethyl-N-methyl-, iodide (1:1)
    • (2-(2-Pyridyl)ethyl)diethylmethylammonium
    • diethyl-methyl-(2-pyridin-2-ylethyl)azanium
    • DTXSID20988639
    • (2-(2-pyridyl)ethyl)diethylmethylammonium iodide
    • N,N-Diethyl-N-methyl-2-(pyridin-2-yl)ethan-1-aminium iodide
    • 2-Pyridineethanaminium, N,N-diethyl-N-methyl-, iodide
    • Ammonium, diethylmethyl(2-(2-pyridyl)ethyl)-, iodide
    • 6893-34-1
    • Diethylmethyl(2-(2-pyridyl)ethyl)ammonium iodide
    • diethyl-methyl-(2-pyridin-2-ylethyl)azanium;iodide
    • CHEMBL15822
    • Inchi: 1S/C12H21N2.HI/c1-4-14(3,5-2)11-9-12-8-6-7-10-13-12;/h6-8,10H,4-5,9,11H2,1-3H3;1H/q+1;/p-1
    • InChI Key: BUTAYBCQUSRQAO-UHFFFAOYSA-M
    • SMILES: [I-].[N+](C)(CC)(CC)CCC1C=CC=CN=1

Computed Properties

  • Exact Mass: 298.9102
  • Monoisotopic Mass: 193.17
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 5
  • Complexity: 152
  • 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: 1.6
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • PSA: 12.89
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