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Substance Name: o-Toluic acid, 3-ethyl-4-propoxy-, ethyl ester
RN: 92730-42-2
InChIKey: BPBJNHAIRBGRNJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H22-O3

Molecular Weight

  • 250.3358
 
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Names and Synonyms

Synonyms

  • 3-Ethyl-4-propoxy-o-toluic acid ethyl ester
  • Benzoic acid, 3-ethyl-2-methyl-4-propoxy-, ethyl ester
  • BRN 2580362
  • Ethyl 3-ethyl-2-methyl-4-propoxybenzoate

Systematic Name

  • o-Toluic acid, 3-ethyl-4-propoxy-, ethyl ester

Registry Numbers

CAS Registry Number

  • 92730-42-2

System Generated Number

  • 0092730422

Structure Descriptors

InChI

1S/C15H22O3/c1-5-10-18-14-9-8-13(15(16)17-7-3)11(4)12(14)6-2/h8-9H,5-7,10H2,1-4H3

InChIKey

BPBJNHAIRBGRNJ-UHFFFAOYSA-N

Smiles

CCCOc1ccc(c(c1CC)C)C(=O)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 840mg/kg (840mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 213, 1960.