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Substance Name: Butyric acid, 2-((2,3,5,6-tetramethylphenyl)thio)-
RN: 72462-85-2
InChIKey: JHSOOUIQAKJGQP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H20-O2-S

Molecular Weight

  • 252.376
 
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Names and Synonyms

Synonyms

  • 2-((2,3,5,6-Tetramethylphenyl)thio)butyric acid
  • BRN 2462285

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 72462-85-2

System Generated Number

  • 0072462852

Structure Descriptors

InChI

1S/C14H20O2S/c1-6-12(14(15)16)17-13-10(4)8(2)7-9(3)11(13)5/h7,12H,6H2,1-5H3,(H,15,16)

InChIKey

JHSOOUIQAKJGQP-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   Bollettino Chimico Farmaceutico. Vol. 118, Pg. 286, 1979.