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Substance Name: 1-Cyclopenteneglycolic acid, alpha-(1-propynyl)-, 2-methyl-3-quinuclidinyl ester
RN: 102571-07-3
InChIKey: UCTOEHTYBBRGKA-UHFFFAOYSA-N

Molecular Formula

  • C18-H25-N-O3

Molecular Weight

  • 303.3995
 
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Names and Synonyms

Synonyms

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

Systematic Name

  • 1-Cyclopenteneglycolic acid, alpha-(1-propynyl)-, 2-methyl-3-quinuclidinyl ester

Registry Numbers

CAS Registry Number

  • 102571-07-3

System Generated Number

  • 0102571073

Structure Descriptors

InChI

1S/C18H25NO3/c1-3-10-18(21,15-6-4-5-7-15)17(20)22-16-13(2)19-11-8-14(16)9-12-19/h6,13-14,16,21H,4-5,7-9,11-12H2,1-2H3

InChIKey

UCTOEHTYBBRGKA-UHFFFAOYSA-N

Smiles

CC#CC(C1=CCCC1)(C(=O)OC2C(N3CCC2CC3)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 71mg/kg (71mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#11937,