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Substance Name: Lauryl isoquinolinium bromide [USAN]
RN: 93-23-2
UNII: 09TM5K0O34
InChIKey: MSJLMQTXVKCUCD-UHFFFAOYSA-M

Classification Codes

  • Agricultural Chemical
  • Anti-Infective
  • Fungicide, Bactericide, Wood Preservative
  • Skin / Eye Irritant

Molecular Formula

  • C21-H32-N.Br

Molecular Weight

  • 378.395
 
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Names and Synonyms

Name of Substance

  • 2-Dodecylisoquinolinium bromide
  • Lauryl isoquinolinium bromide
  • Lauryl isoquinolinium bromide [USAN]

Synonyms

  • 2-Dodecylisoquinolinium bromide
  • 2-Laurylisoquinolinium bromide
  • Caswell No. 520
  • Dodecyl isoquinolinium bromide
  • EINECS 202-230-9
  • EPA Pesticide Chemical Code 069130
  • Intexsan LQ75
  • Isothan
  • Isothan Q-15
  • Isothan Q-75
  • Isothan Q-90
  • Lauryl isoquinolinium bromide
  • Laurylisoquinolinium bromide
  • n-Dodecylisoquinolinium bromide
  • N-Laurylisoquinolinium bromide
  • NSC 20909
  • UNII-09TM5K0O34

Systematic Names

  • 2-Dodecylisoquinolinium bromide
  • Isoquinolinium, 2-dodecyl-, bromide
  • Isoquinolinium, 2-dodecyl-, bromide (1:1)

Registry Numbers

CAS Registry Number

  • 93-23-2

FDA UNII

  • 09TM5K0O34

System Generated Number

  • 0000093232

Molecular Formulas

Molecular Formula

  • C21-H32-N.Br

Molecular Formula Fragments

  • Br
  • C21-H32-N
  • COMPONENT

Structure Descriptors

InChI

1S/C21H32N.BrH/c1-2-3-4-5-6-7-8-9-10-13-17-22-18-16-20-14-11-12-15-21(20)19-22;/h11-12,14-16,18-19H,2-10,13,17H2,1H3;1H/q+1;/p-1

InChIKey

MSJLMQTXVKCUCD-UHFFFAOYSA-M

Smiles

c12c(cc[n+](c1)CCCCCCCCCCCC)cccc2.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 200mg/kg (200mg/kg) GASTROINTESTINAL: OTHER CHANGES Soap and Sanitary Chemicals. Vol. 25, Pg. 125, 1949.
rat LD50 oral 230mg/kg (230mg/kg) GASTROINTESTINAL: OTHER CHANGES Soap and Sanitary Chemicals. Vol. 25, Pg. 125, 1949.