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Substance Name: Propanoic acid, 2,2-dimethyl-, (((4-((4-chlorophenyl)methyl)phenoxy)acetyl)oxy)methyl ester
RN: 57081-42-2
InChIKey: LVKJINIFSYMHOA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-Cl-O5

Molecular Weight

  • 390.8607
 
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Names and Synonyms

Synonyms

  • (((4-((4-Chlorophenyl)methyl)phenoxy)acetyl)oxy)methyl 2,2-dimethylpropanoate
  • BRN 2020328
  • Sgd 151-74

Systematic Name

  • Propanoic acid, 2,2-dimethyl-, (((4-((4-chlorophenyl)methyl)phenoxy)acetyl)oxy)methyl ester

Registry Numbers

CAS Registry Number

  • 57081-42-2

System Generated Number

  • 0057081422

Structure Descriptors

InChI

1S/C21H23ClO5/c1-21(2,3)20(24)27-14-26-19(23)13-25-18-10-6-16(7-11-18)12-15-4-8-17(22)9-5-15/h4-11H,12-14H2,1-3H3

InChIKey

LVKJINIFSYMHOA-UHFFFAOYSA-N

Smiles

CC(C)(C)C(=O)OCOC(=O)COc1ccc(cc1)Cc2ccc(cc2)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.