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84718-96-7

84718-96-7 structural image
Product Name: 2-Phenyl-1-propyl glucuronide
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COMPUTED DESCRIPTORS

Molecular Weight 312.31 g/mol
XLogP3 0.5
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 312.12090297 g/mol
Monoisotopic Mass 312.12090297 g/mol
Topological Polar Surface Area 116 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 369
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes