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58974-96-2

58974-96-2 structural image
Product Name: 1-[2-HYDROXY-6-(2-HYDROXYPROPOXY)-3-PROPYLPHENYL]ETHAN-1-ONE
Formula: C14H20O4
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COMPUTED DESCRIPTORS

Molecular Weight 252.31 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 252.13615911 g/mol
Monoisotopic Mass 252.13615911 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 267
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes