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Substance Name: Butyric acid, 2-ethyl-, 2,2,2-trichloroethyl ester
RN: 4189-10-0
InChIKey: AFGFYWOVFUGCLA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H13-Cl3-O2

Molecular Weight

  • 247.548
 
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Names and Synonyms

Synonyms

  • 2-Ethylbutyric acid, ester with trichloroethanol
  • BRN 2087075
  • Trichloroethyl 2-ethylbutyrate

Systematic Name

  • Butyric acid, 2-ethyl-, 2,2,2-trichloroethyl ester

Registry Numbers

CAS Registry Number

  • 4189-10-0

System Generated Number

  • 0004189100

Structure Descriptors

InChI

1S/C8H13Cl3O2/c1-3-6(4-2)7(12)13-5-8(9,10)11/h6H,3-5H2,1-2H3

InChIKey

AFGFYWOVFUGCLA-UHFFFAOYSA-N

Smiles

C(C(OCC(Cl)(Cl)Cl)=O)(CC)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 900mg/kg (900mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: MUSCLE WEAKNESS
Journal of Pharmacology and Experimental Therapeutics. Vol. 63, Pg. 183, 1938.