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Substance Name: Sulfide, 2-chloroethyl o-nitrophenyl
RN: 62047-27-2
InChIKey: NDGBEMZDTZFYFI-UHFFFAOYSA-N

Molecular Formula

  • C8-H8-Cl-N-O2-S

Molecular Weight

  • 217.675
 
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Names and Synonyms

Synonyms

  • 3-06-00-01057 (Beilstein Handbook Reference)
  • BRN 3268626
  • EINECS 263-390-3

Systematic Names

  • 1-((2-Chloroethyl)thio)-2-nitrobenzene
  • Sulfide, 2-chloroethyl o-nitrophenyl

Registry Numbers

CAS Registry Number

  • 62047-27-2

System Generated Number

  • 0062047272

Structure Descriptors

InChI

1S/C8H8ClNO2S/c9-5-6-13-8-4-2-1-3-7(8)10(11)12/h1-4H,5-6H2

InChIKey

NDGBEMZDTZFYFI-UHFFFAOYSA-N

Smiles

[N+](c1c(SCCCl)cccc1)([O-])=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD oral > 500mg/kg (500mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 21, 1953.