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82326-74-7

82326-74-7 structural image
Product Name: 3-QUINUCLIDINYL XANTHENE-9-CARBOXYLATE H
Formula: 2C21H21NO3.C2H2O4
Synonyms: QNX hemioxalate
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COMPUTED DESCRIPTORS

Molecular Weight 760.8 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 7
Exact Mass 760.29959560 g/mol
Monoisotopic Mass 760.29959560 g/mol
Topological Polar Surface Area 152 Ų
Heavy Atom Count 56
Formal Charge 0
Complexity 551
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 3
Compound Is Canonicalized Yes