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131889-29-7

131889-29-7 structural image
Product Name: HEPTAKIS(3-O-ACETYL-2 6-DI-O-METHYL)-
Formula: C70H112O42
Synonyms: 3-O-Acetyl-2,6-di-O-methyl-β-cyclodextrin
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COMPUTED DESCRIPTORS

Molecular Weight 1625.6 g/mol
XLogP3 -3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 42
Rotatable Bond Count 35
Exact Mass 1624.6628176 g/mol
Monoisotopic Mass 1624.6628176 g/mol
Topological Polar Surface Area 443 Ų
Heavy Atom Count 112
Formal Charge 0
Complexity 2410
Isotope Atom Count 0
Defined Atom Stereocenter Count 35
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes