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3-Butynyl Methanethiosulfonate

3-Butynyl Methanethiosulfonate structure

3-Butynyl Methanethiosulfonate 

structure
  • CAS No:

    1170318-61-2

  • Formula:

    C5H8O2S2

  • Chemical Name:

    3-Butynyl Methanethiosulfonate

  • Synonyms:

    3-Butynyl Methanethiosulfonate;S-But-3-yn-1-yl methanesulfonothioate;CTK8F5012;DTXSID00652503;ZINC22053821;S-(But-3-yn-1-yl) methanesulfonothioate;FT-0664176;Methanethiosulfonic acid S-(3-butynyl) ester

Description

Light Orange Solid

3-Butynyl Methanethiosulfonate Basic Attributes

164.24582

163.997

DTXSID00652503

Characteristics

67.8

0.6

1.265±0.06 g/cm3(Predicted)

313.4±25.0 °C(Predicted)

-20°C Freezer

3-Butynyl Methanethiosulfonate Use and Manufacturing

Reacts specifically and rapidly with thiols to form mixed disulfides.Used to probe thestructures of the ACh receptor channel of the GABA receptor channel and of lactosepermease

Computed Properties

Molecular Weight:164.3
XLogP3:0.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:163.99657184
Monoisotopic Mass:163.99657184
Topological Polar Surface Area:67.8
Heavy Atom Count:9
Complexity:201
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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