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Substance Name: 4-Nitrophenylthiol acetate
RN: 15119-62-7
InChIKey: QCGPFSMQZNLBCA-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Nematocide

Molecular Formula

  • C8-H7-N-O3-S

Molecular Weight

  • 197.213
 
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Names and Synonyms

Name of Substance

  • 4-Nitrophenylthiol acetate

Synonyms

  • Benzenethiol, p-nitro-, acetate (6CI)
  • p-Nitrophenylthiol acetate
  • S-(p-Nitrophenyl) thioacetate

Systematic Names

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

Registry Numbers

CAS Registry Number

  • 15119-62-7

System Generated Number

  • 0015119627

Structure Descriptors

InChI

1S/C8H7NO3S/c1-6(10)13-8-4-2-7(3-5-8)9(11)12/h2-5H,1H3

InChIKey

QCGPFSMQZNLBCA-UHFFFAOYSA-N

Smiles

c1(ccc([N+](=O)[O-])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.