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Substance Name: 4-Biphenylacetic acid, alpha-ethyl-, thymyl ester
RN: 20724-13-4
InChIKey: GNBAJEWDTRDVTA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H28-O2

Molecular Weight

  • 372.505
 
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Names and Synonyms

Synonyms

  • BRN 2017453
  • SAS 552
  • Thymyl alpha-ethyl-4-biphenylacetate

Systematic Name

  • 4-Biphenylacetic acid, alpha-ethyl-, thymyl ester

Registry Numbers

CAS Registry Number

  • 20724-13-4

System Generated Number

  • 0020724134

Structure Descriptors

InChI

1S/C26H28O2/c1-5-23(22-14-12-21(13-15-22)20-9-7-6-8-10-20)26(27)28-25-17-19(4)11-16-24(25)18(2)3/h6-18,23H,5H2,1-4H3

InChIKey

GNBAJEWDTRDVTA-UHFFFAOYSA-N

Smiles

c1(ccc(cc1)[C@@H](C(=O)Oc1c(ccc(c1)C)C(C)C)CC)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2gm/kg (2000mg/kg)   Chimica Therapeutica. Vol. 3, Pg. 433, 1968.
mouse LD50 oral > 2500mg/kg (2500mg/kg)   Chimica Therapeutica. Vol. 3, Pg. 433, 1968.
rat LD50 intraperitoneal > 2gm/kg (2000mg/kg)   Chimica Therapeutica. Vol. 3, Pg. 433, 1968.
rat LD50 oral > 2gm/kg (2000mg/kg)   Chimica Therapeutica. Vol. 3, Pg. 433, 1968.