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Substance Name: Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide
RN: 120402-42-8
InChIKey: XNMBGURZTNGYGN-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H18-N.I

Molecular Weight

  • 315.1922
 
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Names and Synonyms

Synonyms

  • 1,2,3,3-Tetramethyl-3,4-dihydroisoquinolinium iodide
  • 3,4-Dihydro-1,2,3,3-tetramethylisoquinolinium iodide

Systematic Names

  • Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide
  • Isoquinolinium, 3,4-dihydro-1,2,3,4-tetramethyl-, iodide

Registry Numbers

CAS Registry Number

  • 120402-42-8

System Generated Number

  • 0120402428

Molecular Formulas

Molecular Formula

  • C13-H18-N.I

Molecular Formula Fragments

  • C13-H18-N
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C13H18N.HI/c1-10-12-8-6-5-7-11(12)9-13(2,3)14(10)4;/h5-8H,9H2,1-4H3;1H/q+1;/p-1

InChIKey

XNMBGURZTNGYGN-UHFFFAOYSA-M

Smiles

CC1=[N+](C(Cc2c1cccc2)(C)C)C.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 28100ug/kg (28.1mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 23, Pg. 52, 1989.