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Substance Name: Cyclobutaneglycolic acid, alpha-(1-propynyl)-, 3-quinuclidinyl ester
RN: 101030-75-5
InChIKey: LXIZPACCRLUEJK-UHFFFAOYSA-N

Molecular Formula

  • C16-H23-N-O3

Molecular Weight

  • 277.362
 
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Names and Synonyms

Synonyms

  • 3-Pentynoic acid, 2-cyclobutyl-2-hydroxy-, 3-quinuclidinyl ester
  • 3-Quinuclidyl cyclobutyl(1-propynyl)glycolate A

Systematic Name

  • Cyclobutaneglycolic acid, alpha-(1-propynyl)-, 3-quinuclidinyl ester

Registry Numbers

CAS Registry Number

  • 101030-75-5

System Generated Number

  • 0101030755

Structure Descriptors

InChI

1S/C16H23NO3/c1-2-8-16(19,13-4-3-5-13)15(18)20-14-11-17-9-6-12(14)7-10-17/h12-14,19H,3-7,9-11H2,1H3

InChIKey

LXIZPACCRLUEJK-UHFFFAOYSA-N

Smiles

C1([C@@](C(O[C@@H]2C3CCN(C2)CC3)=O)(C#CC)O)CCC1

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#11934,