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Substance Name: 2-Furoic acid, 5-tert-butyl-, 2,2,2-trichloroethyl ester
RN: 63938-45-4
InChIKey: KJANJZUJQIINKA-UHFFFAOYSA-N

Molecular Formula

  • C11-H13-Cl3-O3

Molecular Weight

  • 299.58
 
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Names and Synonyms

Synonyms

  • 5-tert-Butyl-2-furoic acid, ester with trichloroethanol
  • Trichloroethyl 5-tert-butyl-2-furoate

Systematic Name

  • 2-Furoic acid, 5-tert-butyl-, 2,2,2-trichloroethyl ester

Registry Numbers

CAS Registry Number

  • 63938-45-4

System Generated Number

  • 0063938454

Structure Descriptors

InChI

1S/C11H13Cl3O3/c1-10(2,3)8-5-4-7(17-8)9(15)16-6-11(12,13)14/h4-5H,6H2,1-3H3

InChIKey

KJANJZUJQIINKA-UHFFFAOYSA-N

Smiles

o1c(C(OCC(Cl)(Cl)Cl)=O)ccc1C(C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 4gm/kg (4000mg/kg) LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA

GASTROINTESTINAL: GASTRITIS

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Journal of Pharmacology and Experimental Therapeutics. Vol. 63, Pg. 183, 1938.