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Substance Name: Sulfonethylmethane [NF]
RN: 76-20-0
UNII: 217727W28W
InChIKey: LKACJLUUJRMGFK-UHFFFAOYSA-N

Molecular Formula

  • C8-H18-O4-S2

Molecular Weight

  • 242.3582
 

Classification Codes

Classification Code

  • Tumor Data

Superlist Classification Code

  • DEA Schedule III
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Names and Synonyms

Name of Substance

  • Sulfonethylmethane [NF]

Synonyms

  • 2,2-Bis(ethylsulfonyl)butane
  • 3-01-00-02790 (Beilstein Handbook Reference)
  • BRN 1785184
  • Diethylsulfonmethylethylmethane
  • EINECS 200-942-4
  • Methylsulfonal
  • Methylsulfonalum
  • Methylsulphonal
  • Metilosulfonal
  • NSC 3994
  • Sulfonethylmethane
  • Sulfonethylmethanum
  • Trional
  • Trionalon
  • UNII-217727W28W

Systematic Names

  • 2,2-Bis(ethylsulphonyl)butane
  • Butane, 2,2-bis(ethylsulfonyl)-

Superlist Names

  • DEA No. 2605
  • Sulfonethylmethane

Registry Numbers

CAS Registry Number

  • 76-20-0

FDA UNII

  • 217727W28W

System Generated Number

  • 0000076200

Structure Descriptors

InChI

1S/C8H18O4S2/c1-5-8(4,13(9,10)6-2)14(11,12)7-3/h5-7H2,1-4H3

InChIKey

LKACJLUUJRMGFK-UHFFFAOYSA-N

Smiles

CCC(C)(S(=O)(=O)CC)S(=O)(=O)CC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 76 deg C   EXP
log P (octanol-water) 1.830 (none)   EST
Water Solubility 5000 mg/L 16 EXP
Vapor Pressure 1.71E-05 mm Hg 25 EST
Henry's Law Constant 2.18E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.64E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.