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83354-86-3

83354-86-3 structural image
Product Name: (4-(beta-D-Glucopyranosyloxy)phenyl)(4-nitrophenyl)methanone hydrate
Formula: C19H19NO9
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COMPUTED DESCRIPTORS

Molecular Weight 405.4 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 5
Exact Mass 405.10598118 g/mol
Monoisotopic Mass 405.10598118 g/mol
Topological Polar Surface Area 162 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 567
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