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842133-16-8

842133-16-8 structural image
Product Name: D-Glucitol, 1,5-anhydro-1-C-[4-Methyl-3-[(5-phenyl-2-thienyl)Methyl]phenyl]-, (1S)-
Formula: C24H26O5S
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COMPUTED DESCRIPTORS

Molecular Weight 426.5 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 426.15009510 g/mol
Monoisotopic Mass 426.15009510 g/mol
Topological Polar Surface Area 118 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 542
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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