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1415922-03-0

1415922-03-0 structural image
Product Name: Benzenebutanol, 3-hydroxy-α-(2-hydroxy-4,5-dimethoxyphenyl)-4,5-dimethoxy-β,γ-dimethyl-, (-)-
Formula: C22H30O7
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COMPUTED DESCRIPTORS

Molecular Weight 406.5 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 9
Exact Mass 406.19915329 g/mol
Monoisotopic Mass 406.19915329 g/mol
Topological Polar Surface Area 97.6 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 476
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes