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Substance Name: Pyridinium, 1,2,5,6-tetrahydro-5-carboxy-1,1-dimethyl-, iodide, propyl ester
RN: 102206-86-0
InChIKey: UMXFQRUTOKTSIZ-UHFFFAOYSA-M

Molecular Formula

  • C11-H20-N-O2.I

Molecular Weight

  • 325.184
 
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Names and Synonyms

Synonym

  • 1-Methyl-3-carbo-n-propoxy-1,2,5,6-tetrahydropyridinium iodide

Systematic Name

  • Pyridinium, 1,2,5,6-tetrahydro-5-carboxy-1,1-dimethyl-, iodide, propyl ester

Registry Numbers

CAS Registry Number

  • 102206-86-0

System Generated Number

  • 0102206860

Molecular Formulas

Molecular Formula

  • C11-H20-N-O2.I

Molecular Formula Fragments

  • C11-H20-N-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C11H20NO2.HI/c1-4-8-14-11(13)10-6-5-7-12(2,3)9-10;/h5-6,10H,4,7-9H2,1-3H3;1H/q+1;/p-1

InChIKey

UMXFQRUTOKTSIZ-UHFFFAOYSA-M

Smiles

CCCOC(=O)C1C[N+](CC=C1)(C)C.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 2240ug/kg (2.24mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#12538,