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Substance Name: 1-Cyclopenteneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester
RN: 102571-06-2
InChIKey: KJABXOQIRIMCRE-UHFFFAOYSA-N

Molecular Formula

  • C16-H23-N-O3

Molecular Weight

  • 277.3617
 
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Names and Synonyms

Synonyms

  • 1-Methyl-4-piperidyl 1-cyclopentenyl(1-propynyl)glycolate
  • 3-Pentynoic acid, 2-(1-cyclopentenyl)-2-hydroxy-, 1-methyl-4-piperidyl ester

Systematic Name

  • 1-Cyclopenteneglycolic acid, alpha-(1-propynyl)-, 1-methyl-4-piperidyl ester

Registry Numbers

CAS Registry Number

  • 102571-06-2

System Generated Number

  • 0102571062

Structure Descriptors

InChI

1S/C16H23NO3/c1-3-10-16(19,13-6-4-5-7-13)15(18)20-14-8-11-17(2)12-9-14/h6,14,19H,4-5,7-9,11-12H2,1-2H3

InChIKey

KJABXOQIRIMCRE-UHFFFAOYSA-N

Smiles

C([C@@](O)(C#CC)C1=CCCC1)(=O)OC1CCN(CC1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 89mg/kg (89mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#11867,