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Substance Name: Butanoic acid, 2-methyl-2-(4-methylphenoxy)-, ethyl ester, (+-)-
RN: 71547-87-0
InChIKey: LEZVPMAXRLHXMU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H20-O3

Molecular Weight

  • 236.309
 
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Names and Synonyms

Synonyms

  • BRN 3033035
  • Ethyl (+-)-2-methyl-2-(4-methylphenoxy)butanoate
  • Sgd 376-75

Systematic Name

  • Butanoic acid, 2-methyl-2-(4-methylphenoxy)-, ethyl ester, (+-)-

Registry Numbers

CAS Registry Number

  • 71547-87-0

System Generated Number

  • 0071547870

Structure Descriptors

InChI

1S/C14H20O3/c1-5-14(4,13(15)16-6-2)17-12-9-7-11(3)8-10-12/h7-10H,5-6H2,1-4H3

InChIKey

LEZVPMAXRLHXMU-UHFFFAOYSA-N

Smiles

CCC(C)(C(=O)OCC)Oc1ccc(cc1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 3gm/kg (3000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 29, Pg. 711, 1979.