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Substance Name: 1,2-Benzenediol, 3,5-bis((trifluoromethyl)sulfonyl)-
RN: 125629-20-1
InChIKey: LLVHQTRLLOAMAQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H4-F6-O6-S2

Molecular Weight

  • 374.2336
 
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Names and Synonyms

Synonym

  • 3,5-Bis((trifluoromethyl)sulfonyl)-1,2-benzenediol

Systematic Name

  • 1,2-Benzenediol, 3,5-bis((trifluoromethyl)sulfonyl)-

Registry Numbers

CAS Registry Number

  • 125629-20-1

System Generated Number

  • 0125629201

Structure Descriptors

InChI

1S/C8H4F6O6S2/c9-7(10,11)21(17,18)3-1-4(15)6(16)5(2-3)22(19,20)8(12,13)14/h1-2,15-16H

InChIKey

LLVHQTRLLOAMAQ-UHFFFAOYSA-N

Smiles

c1c(cc(c(c1O)O)S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 156mg/kg (156mg/kg)   Helvetica Chimica Acta. Vol. 72, Pg. 952, 1989.