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Substance Name: Benzoxonium chloride [INN]
RN: 19379-90-9
UNII: 12IMO9R11X
InChIKey: UUSQFLGKGQEVCM-UHFFFAOYSA-M

Classification Codes

  • Drug / Therapeutic Agent
  • Germicide, Bactericide, Disinfectant

Molecular Formulas

  • C23-H42-Cl-N-O2
  • C23-H42-N-O2.Cl

Molecular Weight

  • 400.043
 
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Names and Synonyms

Name of Substance

  • Benzoxonium chloride
  • Benzoxonium chloride [INN]

Synonyms

  • Absonal
  • Absonal V
  • Bactofen
  • Beloran
  • Benzoxonii chloridum
  • Benzoxonii chloridum [INN-Latin]
  • Benzoxonium chloride
  • Benzylbis(2-hydroxyethyl)dodecyl ammonium chloride
  • Benzyldodecylbis(2-hydroxyethyl)ammonium chloride
  • Benzyldodecyldiethanolammonium chloride
  • Bialcol
  • Bis(2-hydroxyethyl)benzyl-n-dodecylammonium chloride
  • Bis(2-hydroxyethyl)benzyldodecylammonium chloride
  • Bradophen
  • Caswell No. 416A
  • Chlorure de benzoxonium
  • Chlorure de benzoxonium [INN-French]
  • Cloruro de benzoxonio
  • Cloruro de benzoxonio [INN-Spanish]
  • Cohortan
  • D 301
  • D301
  • Di(2-hydroxyethyl)benzyldodecylammonium chloride
  • Dodecyl bis(2-hydroxyethyl) benzyl ammonium chloride
  • Dodecyl di(2-hydroxyethyl) benzyl ammonium chloride
  • Dodecyl(benzyl)diethanolammonium chloride
  • Dodecyl(dioxyethyl)benzylammonium chloride
  • Dodecyl-di(beta-oxyaethyl)-benzyl-ammoniumchlorid
  • Dodecyl-di(beta-oxyaethyl)-benzyl-ammoniumchlorid [German]
  • Dodecylbis(2-hydroxyethyl)benzylammonium chloride
  • Dodecylbis(beta-hydroxyethyl)benzylammonium chloride
  • Dodecyldi(2-hydroxyethyl)benzylammonium chloride
  • Dodecyldi(beta-hydroxyethyl)benzylammonium chloride
  • EC 243-008-1
  • EINECS 243-008-1
  • EPA Pesticide Chemical Code 069181
  • Katanol C12
  • Laurylbis(2-hydroxyethyl)benzylammonium chloride
  • Lomades
  • N-Dodecyl-N,N-bis(2-hydroxyethyl)benzenemethanaminium chloride
  • NSC 141905
  • Orofar
  • UNII-12IMO9R11X
  • ZY 15021

Systematic Names

  • Ammonium, benzylbis(2-hydroxyethyl)dodecyl-, chloride
  • Ammonium, benzyldodecylbis(2-hydroxyethyl)-, chloride (8CI)
  • Benzenemethanaminium, N-dodecyl-N,N-bis(2-hydroxyethyl)-, chloride
  • Benzenemethanaminium, N-dodecyl-N,N-bis(2-hydroxyethyl)-, chloride (1:1)
  • Benzoxonium chloride
  • Benzyldodecylbis(2-hydroxyethyl)ammonium chloride
  • N-Dodecyl-N,N-bis(2-hydroxyethyl)benzenemethanaminium chloride

Registry Numbers

CAS Registry Number

  • 19379-90-9

FDA UNII

  • 12IMO9R11X

System Generated Number

  • 0019379909

Molecular Formulas

Molecular Formulas

  • C23-H42-Cl-N-O2
  • C23-H42-N-O2.Cl

Molecular Formula Fragments

  • C23-H42-N-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C23H42NO2.ClH/c1-2-3-4-5-6-7-8-9-10-14-17-24(18-20-25,19-21-26)22-23-15-12-11-13-16-23;/h11-13,15-16,25-26H,2-10,14,17-22H2,1H3;1H/q+1;/p-1

InChIKey

UUSQFLGKGQEVCM-UHFFFAOYSA-M

Smiles

[N+](Cc1ccccc1)(CCCCCCCCCCCC)(CCO)CCO.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1584mg/kg (1584mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY OBSTRUCTION

SKIN AND APPENDAGES (SKIN): PRIMARY IRRITATION: AFTER TOPICAL EXPOSURE
Pharmaceutical Chemistry Journal Vol. 10, Pg. 55, 1976.
rat LD50 oral 750mg/kg (750mg/kg)   Egeszsegtudomany. Vol. 32, Pg. 395, 1988.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 108 deg C   EXP
log P (octanol-water) 1.390 (none)   EST
Atmospheric OH Rate Constant 6.79E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.