Cas no 7181-87-5 (1,3-Dimethyl-1H-benzodimidazol-3-ium iodide)

1,3-Dimethyl-1H-benzodimidazol-3-ium iodide structure
7181-87-5 structure
Product Name:1,3-Dimethyl-1H-benzodimidazol-3-ium iodide
CAS No:7181-87-5
MF:C9H11IN2
MW:274.101514101028
MDL:MFCD00491277
CID:976742
PubChem ID:329762811
Update Time:2025-04-19

1,3-Dimethyl-1H-benzodimidazol-3-ium iodide Chemical and Physical Properties

Names and Identifiers

    • 1,3-Dimethyl-1H-benzo[d]imidazol-3-ium iodide
    • 1,3-DIMETHYL-1H-BENZIMIDAZOL-3-IUM IODIDE
    • 1,3-dimethylbenzimidazol-3-ium,iodide
    • 1,3-dimethyl-1,3-benzodiazol-1-ium iodide
    • 1,3-dimethylbenzimidazol-3-ium
    • 1,3-dimethylbenzimidazoli-2-ylidene iodide
    • 1,3-dimethylbenzimidazolium Iodide
    • AGN-PC-00GV2A
    • iodure de dimethyl-1,3 benzimidazolium
    • KB-86928
    • N,N'-dimethylbenzimidazolium iodide
    • N,N'-dimethylbenzimidazolyl iodide
    • NSC27984
    • DTXSID30473829
    • AKOS022182930
    • 1,3-dimethyl-1H-1,3-benzodiazol-3-ium iodide
    • DS-17175
    • C76285
    • NSC-27984
    • MFCD00491277
    • CS-0091484
    • RQGURHMTNSNBQX-UHFFFAOYSA-M
    • SY257402
    • 1,3-dimethylbenzimidazol-3-ium;iodide
    • SCHEMBL1744004
    • 7181-87-5
    • 1,3-dimethyl-3H-benzimidazol-1-ium-iodide
    • 1,3-Dimethyl-1H-benzimidazolium iodide
    • 1,3-Dimethyl-1H-benzo[d]imidazol-3-iumiodide
    • 1,3-Dimethyl-benzimidazolium iodide
    • 1,3-Dimethyl-1H-1,3-benzodiazol-3-ium iodide monohydrate
    • 5470-77-9
    • 1,3-Dimethyl-1H-benzodimidazol-3-ium iodide
    • MDL: MFCD00491277
    • Inchi: 1S/C9H11N2.HI/c1-10-7-11(2)9-6-4-3-5-8(9)10;/h3-7H,1-2H3;1H/q+1;/p-1
    • InChI Key: RQGURHMTNSNBQX-UHFFFAOYSA-M
    • SMILES: [I-].[N+]1(C)=CN(C)C2C=CC=CC1=2

Computed Properties

  • Exact Mass: 147.09233
  • Monoisotopic Mass: 273.997
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 131
  • 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: 8.8A^2

Experimental Properties

  • Melting Point: 137-142?°C
  • PSA: 8.81
  • LogP: -1.99320

1,3-Dimethyl-1H-benzodimidazol-3-ium iodide Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:2

1,3-Dimethyl-1H-benzodimidazol-3-ium iodide Pricemore >>

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