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Substance Name: o-Toluic acid, 3-ethyl-4-propoxy-
RN: 92156-98-4
InChIKey: ABBXDXILOYVREI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H18-O3

Molecular Weight

  • 222.2822
 
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Names and Synonyms

Synonyms

  • 3-Ethyl-2-methyl-4-propoxybenzoic acid
  • 3-Ethyl-4-propoxy-o-toluic acid
  • Benzoic acid, 3-ethyl-2-methyl-4-propoxy-
  • BRN 2579557

Systematic Name

  • o-Toluic acid, 3-ethyl-4-propoxy-

Registry Numbers

CAS Registry Number

  • 92156-98-4

System Generated Number

  • 0092156984

Structure Descriptors

InChI

1S/C13H18O3/c1-4-8-16-12-7-6-11(13(14)15)9(3)10(12)5-2/h6-7H,4-5,8H2,1-3H3,(H,14,15)

InChIKey

ABBXDXILOYVREI-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 530mg/kg (530mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 213, 1960.