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869308-45-2

869308-45-2 structural image
Product Name: 3-(6-HYDROXYHEXYL)METHYL-2,5,9-TRIMETHYL-7H-FURO[3,2-G]-[1]BENZOPYRAN-7-ONE
Formula: C21H26O5
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COMPUTED DESCRIPTORS

Molecular Weight 358.4 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 8
Exact Mass 358.17802393 g/mol
Monoisotopic Mass 358.17802393 g/mol
Topological Polar Surface Area 68.9 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 517
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes