Cas no 3010-00-2 (Ethanaminium,N-(cyanomethyl)-N-ethyl-N-methyl-, iodide (1:1))

Ethanaminium,N-(cyanomethyl)-N-ethyl-N-methyl-, iodide (1:1) structure
3010-00-2 structure
Product Name:Ethanaminium,N-(cyanomethyl)-N-ethyl-N-methyl-, iodide (1:1)
CAS No:3010-00-2
MF:C7H15IN2
MW:254.111873865128
CID:319465
PubChem ID:18162
Update Time:2025-04-19

Ethanaminium,N-(cyanomethyl)-N-ethyl-N-methyl-, iodide (1:1) Chemical and Physical Properties

Names and Identifiers

    • Ethanaminium,N-(cyanomethyl)-N-ethyl-N-methyl-, iodide (1:1)
    • cyanomethyl-diethyl-methylazanium,iodide
    • N-(Cyanomethyl)-N-ethyl-N-methylethanaminium iodide
    • Acetonitrile, (diethylamino)-, methyl iodide
    • (Cyanomethyl)diethylmethylammonium iodide
    • DTXSID00952510
    • AMMONIUM, (CYANOMETHYL)DIETHYLMETHYL-, IODIDE
    • 3010-00-2
    • Inchi: 1S/C7H15N2.HI/c1-4-9(3,5-2)7-6-8;/h4-5,7H2,1-3H3;1H/q+1;/p-1
    • InChI Key: GQSSPFXFEBCPPC-UHFFFAOYSA-M
    • SMILES: [I-].[N+](C)(CC#N)(CC)CC

Computed Properties

  • Exact Mass: 238.9102
  • Monoisotopic Mass: 254.02800g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 3
  • Complexity: 116
  • 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: 23.8?2

Experimental Properties

  • PSA: 23.79
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