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Substance Name: Benzene, 1-methyl-4-(phenylsulfonyl)-
RN: 640-57-3
InChIKey: YBRXHRWLEFCFEG-UHFFFAOYSA-N

Molecular Formula

  • C13-H12-O2-S

Molecular Weight

  • 232.302
 
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Names and Synonyms

Synonyms

  • 1-Methyl-4-(phenylsulfonyl)benzene
  • 4-06-00-02171 (Beilstein Handbook Reference)
  • 4-Methyldiphenylsulfone
  • 4-Methylphenyl phenyl sulfone
  • AI3-08945
  • Benzene, 1-methyl-4-(phenylsulfonyl)-
  • BRN 1872872
  • EINECS 211-364-7
  • NSC 2724
  • NSC 633012
  • NSC 91059
  • p-Tolyl phenyl sulfone
  • Phenyl p-tolyl sulfone

Systematic Names

  • Benzene, 1-methyl-4-(phenylsulfonyl)-
  • p-(Phenylsulphonyl)toluene
  • Sulfone, phenyl p-tolyl

Registry Numbers

CAS Registry Number

  • 640-57-3

System Generated Number

  • 0000640573

Structure Descriptors

InChI

1S/C13H12O2S/c1-11-7-9-13(10-8-11)16(14,15)12-5-3-2-4-6-12/h2-10H,1H3

InChIKey

YBRXHRWLEFCFEG-UHFFFAOYSA-N

Smiles

O=S(=O)(c1ccc(cc1)C)c1ccccc1

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. 42, 1953.