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Substance Name: alpha-Thenoate bromo thymol
RN: 36050-29-0
InChIKey: USCVXWYHYFTCBK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H15-Br-O2-S

Molecular Weight

  • 339.251
 
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Names and Synonyms

Results Name

  • alpha-Thenoate bromo thymol

Synonyms

  • 4-Bromo-5-methyl-2-(1-methylethyl)phenyl 2-thiophenecarboxylate
  • alpha-Thenoate bromo thymol
  • alpha-Thenoate bromo thymol [French]

Systematic Name

  • 2-Thiophenecarboxylic acid, 4-bromo-5-methyl-2-(1-methylethyl)phenyl ester

Registry Numbers

CAS Registry Number

  • 36050-29-0

System Generated Number

  • 0036050290

Structure Descriptors

InChI

InChI=1S/C15H15BrO2S/c1-9(2)11-8-12(16)10(3)7-13(11)18-15(17)14-5-4-6-19-14/h4-9H,1-3H3

InChIKey

USCVXWYHYFTCBK-UHFFFAOYSA-N

Smiles

CC(C)c1cc(Br)c(C)cc1OC(=O)c2cccs2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1988mg/kg (1988mg/kg)   French Demande Patent Document. Vol. #2059958,