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Substance Name: Acetic acid, thio-, S-(p-bromophenyl) ester
RN: 28122-76-1
InChIKey: ZILDXZXTWVSRDE-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Nematocide

Molecular Formula

  • C8-H7-Br-O-S

Molecular Weight

  • 231.112
 
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Names and Synonyms

Synonyms

  • 4-06-00-01654 (Beilstein Handbook Reference)
  • BRN 1940540
  • NSC 99890
  • S-(p-Bromophenyl) thioacetate

Systematic Names

  • Acetic acid, thio-, S-(p-bromophenyl) ester
  • Ethanethioic acid, S-(4-bromophenyl) ester (9CI)

Registry Numbers

CAS Registry Number

  • 28122-76-1

System Generated Number

  • 0028122761

Structure Descriptors

InChI

1S/C8H7BrOS/c1-6(10)11-8-4-2-7(9)3-5-8/h2-5H,1H3

InChIKey

ZILDXZXTWVSRDE-UHFFFAOYSA-N

Smiles

c1(ccc(Br)cc1)SC(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3gm/kg (3000mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 89, Pg. 1179, 1969.