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Substance Name: 1,2-Benzenediol, 3,5-bis(methylsulfonyl)-
RN: 125629-19-8
InChIKey: MCRNEKQTLQYVFD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H10-O6-S2

Molecular Weight

  • 266.293
 
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Names and Synonyms

Synonym

  • 3,5-Bis(methylsulfonyl)-1,2-benzenediol

Systematic Name

  • 1,2-Benzenediol, 3,5-bis(methylsulfonyl)-

Registry Numbers

CAS Registry Number

  • 125629-19-8

System Generated Number

  • 0125629198

Structure Descriptors

InChI

1S/C8H10O6S2/c1-15(11,12)5-3-6(9)8(10)7(4-5)16(2,13)14/h3-4,9-10H,1-2H3

InChIKey

MCRNEKQTLQYVFD-UHFFFAOYSA-N

Smiles

CS(=O)(=O)c1cc(c(c(c1)S(=O)(=O)C)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 5gm/kg (5000mg/kg)   Helvetica Chimica Acta. Vol. 72, Pg. 952, 1989.