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Substance Name: 2-Thiophenecarboxylic acid, bromo-2-methoxy-4-methylphenyl ester
RN: 36472-20-5
InChIKey: BZMDDSWEDFUALV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H11-Br-O3-S

Molecular Weight

  • 327.197
 
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Names and Synonyms

Synonyms

  • alpha-Thenoate bromocreosol
  • alpha-Thenoate bromocreosol [French]
  • Bromo-2-methoxy-4-methylphenyl 2-thiophenecarboxylate

Systematic Name

  • 2-Thiophenecarboxylic acid, bromo-2-methoxy-4-methylphenyl ester

Registry Numbers

CAS Registry Number

  • 36472-20-5

System Generated Number

  • 0036472205

Structure Descriptors

InChI

1S/C13H11BrO3S/c1-8-5-6-9(12(16-2)11(8)14)17-13(15)10-4-3-7-18-10/h3-7H,1-2H3

InChIKey

BZMDDSWEDFUALV-UHFFFAOYSA-N

Smiles

c1(cccs1)C(=O)Oc1c(c(c(cc1)C)Br)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3020mg/kg (3020mg/kg)   French Demande Patent Document. Vol. #2059958,