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98074-19-2

98074-19-2 structural image
Product Name: 8-(2-(Methylthio)ethyl)-1-alpha-H,5-alpha-H-nortropan-3-beta-ol benzoa te hydrochloride
Formula: C17H23NO2S.ClH
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COMPUTED DESCRIPTORS

Molecular Weight 341.9 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 341.1216279 g/mol
Monoisotopic Mass 341.1216279 g/mol
Topological Polar Surface Area 54.8 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 343
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes