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Substance Name: Propanoic acid, 2-(4-cyanophenoxy)-2-methyl-, ethyl ester
RN: 18672-07-6
InChIKey: CXAFOUVBWLSQHX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H15-N-O3

Molecular Weight

  • 233.266
 
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Names and Synonyms

Synonyms

  • BRN 3095814
  • Ethyl 2-(4-cyanophenoxy)-2-methylpropanoate

Systematic Name

  • Propanoic acid, 2-(4-cyanophenoxy)-2-methyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 18672-07-6

System Generated Number

  • 0018672076

Structure Descriptors

InChI

1S/C13H15NO3/c1-4-16-12(15)13(2,3)17-11-7-5-10(9-14)6-8-11/h5-8H,4H2,1-3H3

InChIKey

CXAFOUVBWLSQHX-UHFFFAOYSA-N

Smiles

C(C(C)(C)Oc1ccc(cc1)C#N)(=O)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 2gm/kg (2000mg/kg)   Annales Pharmaceutiques Francaises. Vol. 47, Pg. 16, 1989.