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Substance Name: Ammonium, (3-carboxyallyl)trimethyl-, perchlorate, methyl ester
RN: 51314-35-3
InChIKey: QDAXFYWPHOIVEV-IPZCTEOASA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H16-N-O2.Cl-O4

Molecular Weight

  • 257.668
 
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Names and Synonyms

Synonyms

  • (3-Carboxyallyl)trimethylammonium perchlorate methyl ester
  • Krotonsaeurebetainmethylesterperchlorat
  • Krotonsaeurebetainmethylesterperchlorat [German]

Systematic Name

  • Ammonium, (3-carboxyallyl)trimethyl-, perchlorate, methyl ester

Registry Numbers

CAS Registry Number

  • 51314-35-3

System Generated Number

  • 0051314353

Molecular Formulas

Molecular Formula

  • C8-H16-N-O2.Cl-O4

Molecular Formula Fragments

  • C8-H16-N-O2
  • Cl-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C8H16NO2.ClHO4/c1-9(2,3)7-5-6-8(10)11-4;2-1(3,4)5/h5-6H,7H2,1-4H3;(H,2,3,4,5)/q+1;/p-1/b6-5+;

InChIKey

QDAXFYWPHOIVEV-IPZCTEOASA-M

Smiles

Cl(=O)([O-])(=O)=O.[N+](C\C=C\C(OC)=O)(C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 7700ug/kg (7.7mg/kg) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Acta Biologica et Medica Germanica. Vol. 35, Pg. 645, 1976.