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Substance Name: Benzyldimethylstearylammonium chloride
RN: 122-19-0
UNII: 0OUO26BB88
InChIKey: SFVFIFLLYFPGHH-UHFFFAOYSA-M

Classification Codes

  • Drug / Therapeutic Agent
  • Skin / Eye Irritant

Molecular Formula

  • C27-H50-N.Cl

Molecular Weight

  • 424.152
 
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Names and Synonyms

Name of Substance

  • Benzenemethanaminium, N,N-dimethyl-N-octadecyl-, chloride
  • Benzyl dimethyl stearyl ammonium chloride
  • Benzyldimethylstearylammonium chloride
  • N,N-Dimethyl-N-octadecylbenzenemethanaminium chloride
  • Stearalkonium chloride
  • Stearyl dimethyl benzyl ammonium chloride

Synonyms

  • 2B
  • 2B (onium compound)
  • AI3-09119
  • Algene SC 25
  • Alkaquat DMB-ST
  • Ammonium, benzyldimethyloctadecyl-, chloride
  • Ammonyx 4
  • Ammonyx 4002
  • Ammonyx 485
  • Ammonyx 490
  • Ammonyx CA special
  • Arquad DM18B-90
  • Barquat SB-25
  • Benzenemethanaminium, N,N-dimethyl-N-octadecyl-, chloride
  • Benzyldimethyloctadecylammonium chloride
  • Benzyldimethylstearylammonium chloride
  • Benzyloctadecyldimethylammonium chloride
  • Benzylstearyldimethylammonium chloride
  • Carsoquat sdq-25
  • Carsoquat sdq-85
  • Cation S (surfactant)
  • CCRIS 6022
  • Dimethyl octadecyl benzyl ammonium chloride
  • Dimethyl(N-octadecylphenylmethyl)ammonium chloride
  • Dimethylbenzyloctadecylammonium chloride
  • Dimethyloctadecylbenzylammonium chloride
  • EINECS 204-527-9
  • HSDB 6123
  • Incroquat SDQ 25
  • Intexan SB-85
  • Intexsan SB-85
  • J Soft C 4
  • Larostat HTS 905
  • Mackernium SDC 25
  • Mackernium SDC 85
  • Maquat SC 18
  • N-Octadecyl-N-benzyl-N,N-dimethylammonium chloride
  • Nissan cation S2-100
  • NSC 20199
  • Octadecylbenzyldimethylammonium chloride
  • Octadecyldimethylbenzylammonium chloride
  • Orthosan MB
  • Quaternol 1
  • SDQ 25
  • SDQ 85
  • Stearalkonium chloride
  • Stearyldimethylbenzylammonium chloride
  • Stebac
  • Stedbac
  • Swanol CA 1485
  • Tallow benzyl dimethyl ammonium chloride
  • Triton CG 400
  • Triton CG 500
  • Triton X-40
  • Triton X-400
  • UNII-0OUO26BB88
  • Varisoft SDC 85

Systematic Names

  • Ammonium, benzyldimethyloctadecyl-, chloride
  • Benzenemethanaminium, N,N-dimethyl-N-octadecyl-, chloride
  • Benzenemethanaminium, N,N-dimethyl-N-octadecyl-, chloride (1:1)
  • Benzyldimethyl(octadecyl)ammonium chloride
  • Dimethyloctadecylbenzylammonium chloride

Superlist Names

  • Ammonium, benzyldimethyloctadecyl-, chloride
  • Dimethyl octadecyl benzyl ammonium chloride

Registry Numbers

CAS Registry Number

  • 122-19-0

FDA UNII

  • 0OUO26BB88

Other Registry Numbers

  • 37243-60-0
  • 60650-76-2
  • 89004-38-6

Related Registry Number

  • 37612-69-4 (Parent)

System Generated Number

  • 0000122190

Molecular Formulas

Molecular Formula

  • C27-H50-N.Cl

Molecular Formula Fragments

  • C27-H50-N
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C27H50N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28(2,3)26-27-23-20-19-21-24-27;/h19-21,23-24H,4-18,22,25-26H2,1-3H3;1H/q+1;/p-1

InChIKey

SFVFIFLLYFPGHH-UHFFFAOYSA-M

Smiles

c1(C[N+](CCCCCCCCCCCCCCCCCC)(C)C)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 500mg/kg (500mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 49(8), Pg. 90, 1984.
mouse LD50 oral 760mg/kg (760mg/kg)   Journal of the American College of Toxicology. Vol. 1(2), Pg. 57, 1982.
rat LD50 oral 1250mg/kg (1250mg/kg)   Journal of the American College of Toxicology. Vol. 1(2), Pg. 57, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Atmospheric OH Rate Constant 4.93E-11 cm3/molecule-sec 25 EST

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