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120336-45-0

120336-45-0 structural image
Product Name: HEXAKIS-(2,6-DI-O-PENTYL)-ALPHA-CYCLODEXTRIN
Formula: C96H180O30
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COMPUTED DESCRIPTORS

Molecular Weight 1814.4 g/mol
XLogP3 15.1
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 30
Rotatable Bond Count 66
Exact Mass 1814.25929915 g/mol
Monoisotopic Mass 1813.25594432 g/mol
Topological Polar Surface Area 343 Ų
Heavy Atom Count 126
Formal Charge 0
Complexity 2150
Isotope Atom Count 0
Defined Atom Stereocenter Count 30
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes