Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2,6,7-Trioxabicyclo(2.2.2)octane, 4-ethyl-
RN: 4171-93-1
InChIKey: IGRGZFDQPRQUMK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H12-O3

Molecular Weight

  • 144.169
 
* 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

  • 4-Ethyl-2,6,7-trioxabicyclo(2.2.2)octane
  • AI3-26912()C

Systematic Name

  • 2,6,7-Trioxabicyclo(2.2.2)octane, 4-ethyl-

Registry Numbers

CAS Registry Number

  • 4171-93-1

System Generated Number

  • 0004171931

Structure Descriptors

InChI

1S/C7H12O3/c1-2-7-3-8-6(9-4-7)10-5-7/h6H,2-5H2,1H3

InChIKey

IGRGZFDQPRQUMK-UHFFFAOYSA-N

Smiles

C12OCC(CO1)(CO2)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 95mg/kg (95mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: ATAXIA

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Toxicology and Applied Pharmacology. Vol. 36, Pg. 261, 1976.