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82064-07-1

82064-07-1 structural image
Product Name: D-Glucitol,2,5-anhydro-,4,6-dibenzoate 1-(4-methylbenzenesulfonate)
Formula: C27H26O9S
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COMPUTED DESCRIPTORS

Molecular Weight 526.6 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 11
Exact Mass 526.12975358 g/mol
Monoisotopic Mass 526.12975358 g/mol
Topological Polar Surface Area 134 Ų
Heavy Atom Count 37
Formal Charge 0
Complexity 850
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 4
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes