Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Propanoic acid, 2-(4-((4-chlorophenyl)methyl)phenoxy)-2-methyl-, cyclopentyl ester
RN: 57081-33-1
InChIKey: XXHYZHKLELFPQE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H25-Cl-O3

Molecular Weight

  • 372.8895
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • BRN 3008890
  • Cyclopentyl 2-(4-((4-chlorophenyl)methyl)phenoxy)-2-methylpropanoate
  • Sgd 259-74

Systematic Name

  • Propanoic acid, 2-(4-((4-chlorophenyl)methyl)phenoxy)-2-methyl-, cyclopentyl ester

Registry Numbers

CAS Registry Number

  • 57081-33-1

System Generated Number

  • 0057081331

Structure Descriptors

InChI

1S/C22H25ClO3/c1-22(2,21(24)25-19-5-3-4-6-19)26-20-13-9-17(10-14-20)15-16-7-11-18(23)12-8-16/h7-14,19H,3-6,15H2,1-2H3

InChIKey

XXHYZHKLELFPQE-UHFFFAOYSA-N

Smiles

CC(C)(C(=O)OC1CCCC1)Oc2ccc(cc2)Cc3ccc(cc3)Cl

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.