Cas no 97975-94-5 (Benzenemethanaminium,2,4-dichloro-N-[(2,4-dichlorophenyl)methyl]-N,N-dimethyl-, chloride (1:1))

Benzenemethanaminium,2,4-dichloro-N-[(2,4-dichlorophenyl)methyl]-N,N-dimethyl-, chloride (1:1) structure
97975-94-5 structure
Product Name:Benzenemethanaminium,2,4-dichloro-N-[(2,4-dichlorophenyl)methyl]-N,N-dimethyl-, chloride (1:1)
CAS No:97975-94-5
MF:C16H16Cl5N
MW:399.569939613342
CID:807977
PubChem ID:3025058
Update Time:2025-04-19

Benzenemethanaminium,2,4-dichloro-N-[(2,4-dichlorophenyl)methyl]-N,N-dimethyl-, chloride (1:1) Chemical and Physical Properties

Names and Identifiers

    • Benzenemethanaminium,2,4-dichloro-N-[(2,4-dichlorophenyl)methyl]-N,N-dimethyl-, chloride (1:1)
    • bis(2,4-dichlorobenzyl)dimethylammonium chloride
    • bis[(2,4-dichlorophenyl)methyl]-dimethylazanium,chloride
    • NS00066689
    • EINECS 308-421-4
    • bis-(2,4-Dichlorobenzyl)dimethylammonium chloride
    • (2,4-Dichlorophenyl)-N-[(2,4-dichlorophenyl)methyl]-N,N-dimethylmethanaminium chloride
    • DTXSID30913513
    • 97975-94-5
    • Inchi: 1S/C16H16Cl4N.ClH/c1-21(2,9-11-3-5-13(17)7-15(11)19)10-12-4-6-14(18)8-16(12)20;/h3-8H,9-10H2,1-2H3;1H/q+1;/p-1
    • InChI Key: NQPUHJCCECUSEO-UHFFFAOYSA-M
    • SMILES: ClC1C=C(C=CC=1C[N+](C)(C)CC1C=CC(=CC=1Cl)Cl)Cl.[Cl-]

Computed Properties

  • Exact Mass: 398.969588
  • Monoisotopic Mass: 396.972538
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 4
  • Complexity: 306
  • 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: 0

Experimental Properties

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

Benzenemethanaminium,2,4-dichloro-N-[(2,4-dichlorophenyl)methyl]-N,N-dimethyl-, chloride (1:1) Related Literature

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