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Substance Name: p-Cymene-2-carboxylic acid, 3-propoxy-
RN: 53206-94-3
InChIKey: FUKGUAVFRQEKLQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H20-O3

Molecular Weight

  • 236.309
 
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Names and Synonyms

Synonyms

  • Benzoic acid, 3-isopropyl-2-propoxy-6-methyl-
  • BRN 2373682

Systematic Name

  • p-Cymene-2-carboxylic acid, 3-propoxy-

Registry Numbers

CAS Registry Number

  • 53206-94-3

System Generated Number

  • 0053206943

Structure Descriptors

InChI

1S/C14H20O3/c1-5-8-17-13-11(9(2)3)7-6-10(4)12(13)14(15)16/h6-7,9H,5,8H2,1-4H3,(H,15,16)

InChIKey

FUKGUAVFRQEKLQ-UHFFFAOYSA-N

Smiles

c1(c(c(ccc1C(C)C)C)C(O)=O)OCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 160mg/kg (160mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 156, 1974.