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Substance Name: Benzohexonium
RN: 971-60-8
UNII: V26UVZ0360
InChIKey: KQHXGIXCFWNHSW-UHFFFAOYSA-L

Classification Codes

  • Anti-Ulcer Agents
  • Autonomic Agents
  • Drug / Therapeutic Agent
  • Ganglionic Blockers
  • Gastrointestinal Agents
  • Peripheral Nervous System Agents
  • Reproductive Effect

Molecular Formula

  • C12-H30-N2.C12-H10-O3-S

Molecular Weight

  • 516.72
 
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Names and Synonyms

Name of Substance

  • Benzohexonium

Synonyms

  • Benzohexonium
  • Hexamethylenebis(trimethylammonium) dibenzenesulfonate
  • UNII-V26UVZ0360

Systematic Names

  • 1,6-Hexanediaminium, N,N,N,N',N',N'-hexamethyl-, dibenzenesulfonate (9CI)
  • Ammonium, hexamethylenebis(trimethyl-, dibenzenesulfonate
  • N,N,N,N',N',N'-Hexamethyl-1,6-hexanediaminium, dibenzenesulfonate

Registry Numbers

CAS Registry Number

  • 971-60-8

FDA UNII

  • V26UVZ0360

System Generated Number

  • 0000971608

Molecular Formulas

Molecular Formula

  • C12-H30-N2.C12-H10-O3-S

Molecular Formula Fragments

  • C12-H10-O3-S
  • C12-H30-N2
  • COMPONENT

Structure Descriptors

InChI

1S/C12H30N2.2C6H6O3S/c1-13(2,3)11-9-7-8-10-12-14(4,5)6;2*7-10(8,9)6-4-2-1-3-5-6/h7-12H2,1-6H3;2*1-5H,(H,7,8,9)/q+2;;/p-2

InChIKey

KQHXGIXCFWNHSW-UHFFFAOYSA-L

Smiles

c1(ccccc1)S(=O)(=O)[O-].c1(S(=O)(=O)[O-])ccccc1.C(CCCC[N+](C)(C)C)C[N+](C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 166mg/kg (166mg/kg)   Russian Pharmacology and Toxicology Vol. 31, Pg. 53, 1968.