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Substance Name: Butyric acid, 2-((2,3,5,6-tetramethylphenyl)thio)-, ethyl ester
RN: 72462-76-1
InChIKey: WOIDZQLOMMXDKB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H24-O2-S

Molecular Weight

  • 280.43
 
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Names and Synonyms

Synonyms

  • 2-((2,3,5,6-Tetramethylphenyl)thio)butyric acid ethyl ester
  • BRN 2466126

Systematic Name

  • Butyric acid, 2-((2,3,5,6-tetramethylphenyl)thio)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 72462-76-1

System Generated Number

  • 0072462761

Structure Descriptors

InChI

1S/C16H24O2S/c1-7-14(16(17)18-8-2)19-15-12(5)10(3)9-11(4)13(15)6/h9,14H,7-8H2,1-6H3

InChIKey

WOIDZQLOMMXDKB-UHFFFAOYSA-N

Smiles

c1(c(c(cc(c1C)C)C)C)S[C@@H](C(OCC)=O)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1800mg/kg (1800mg/kg)   Bollettino Chimico Farmaceutico. Vol. 118, Pg. 286, 1979.