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Substance Name: Benzonitrile, 4-ethoxyethylsulfonyl-2,3,5,6-tetrachloro-
RN: 56916-72-4
InChIKey: GBITXFDURSIVHU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H9-Cl4-N-O3-S

Molecular Weight

  • 377.074
 
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Names and Synonyms

Synonyms

  • 4-Ethoxyethylsulfonyl-2,3,5,6-tetrachlorobenzonitrile
  • BRN 2602253

Systematic Name

  • Benzonitrile, 4-ethoxyethylsulfonyl-2,3,5,6-tetrachloro-

Registry Numbers

CAS Registry Number

  • 56916-72-4

System Generated Number

  • 0056916724

Structure Descriptors

InChI

1S/C11H9Cl4NO3S/c1-2-19-3-4-20(17,18)11-9(14)7(12)6(5-16)8(13)10(11)15/h2-4H2,1H3

InChIKey

GBITXFDURSIVHU-UHFFFAOYSA-N

Smiles

c1(c(c(c(C#N)c(c1Cl)Cl)Cl)Cl)S(CCOCC)(=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 237mg/kg (237mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 906, 1978.