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Substance Name: Propionic acid, 2-(4-(4-chlorobenzyl)phenoxy)-, isobutyl ester, (+-)-
RN: 71565-48-5
InChIKey: NCQPUEYKSNKYHJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H23-Cl-O3

Molecular Weight

  • 346.8517
 
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Names and Synonyms

Synonyms

  • (+-)-2-(4-(4-Chlorobenzyl)phenoxy)propionic acid isobutyl ester
  • (+-)-Isobutyl 2-(4-(4-chlorobenzyl)phenoxy)propionate
  • BRN 2998644
  • Propanoic acid, 2-(4-((4-chlorophenyl)methyl)phenoxy)-, 2-methylpropyl ester, (+-)-
  • Sgd 333-75

Systematic Name

  • Propionic acid, 2-(4-(4-chlorobenzyl)phenoxy)-, isobutyl ester, (+-)-

Registry Numbers

CAS Registry Number

  • 71565-48-5

System Generated Number

  • 0071565485

Structure Descriptors

InChI

1S/C20H23ClO3/c1-14(2)13-23-20(22)15(3)24-19-10-6-17(7-11-19)12-16-4-8-18(21)9-5-16/h4-11,14-15H,12-13H2,1-3H3

InChIKey

NCQPUEYKSNKYHJ-UHFFFAOYSA-N

Smiles

CC(C)COC(=O)C(C)Oc1ccc(cc1)Cc2ccc(cc2)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2900mg/kg (2900mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 29, Pg. 711, 1979.