Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2-Thiopheneglycolic acid, alpha-isopropenyl-, 3-quinuclidinyl ester
RN: 102367-39-5
InChIKey: XNSVDTZPCHJQSE-UHFFFAOYSA-N

Molecular Formula

  • C16-H21-N-O3-S

Molecular Weight

  • 307.4119
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 3-Butenoic acid, 2-hydroxy-3-methyl-2-(2-thienyl)-, 3-quinuclidinyl ester
  • 3-Quinuclidyl-2-thienyl(isopropenyl)glycolate
  • alpha-Isopropenyl-2-thiopheneglycolic acid 3-quinuclidinyl ester

Systematic Name

  • 2-Thiopheneglycolic acid, alpha-isopropenyl-, 3-quinuclidinyl ester

Registry Numbers

CAS Registry Number

  • 102367-39-5

System Generated Number

  • 0102367395

Structure Descriptors

InChI

1S/C16H21NO3S/c1-10(2)12-5-8-21-15(12)14(18)16(19)20-13-9-17-6-3-11(13)4-7-17/h5,8,11,13-14,18H,1,3-4,6-7,9H2,2H3

InChIKey

XNSVDTZPCHJQSE-UHFFFAOYSA-N

Smiles

CC(=C)c1ccsc1C(C(=O)OC2CN3CCC2CC3)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#11897,