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94089-02-8

94089-02-8 structural image
Product Name: 1-(2'-THIENYL)ETHYLMERCAPTAN
Formula: C6H8S2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colourless clear liquid; Strong mercaptan aroma
Solubility Very slightly soluble in water
Density 1.141-1.151
Refractive Index 1.568-1.578
Kovats Retention Index 1136

COMPUTED DESCRIPTORS

Molecular Weight 144.3 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 144.00674260 g/mol
Monoisotopic Mass 144.00674260 g/mol
Topological Polar Surface Area 29.2 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 72.9
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes