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898773-02-9

898773-02-9 structural image
Product Name: 5-(1,3-DIOXOLAN-2-YL)-2-THIENYL 2,4,4-TRIMETHYLPENTYL KETONE
Formula: C16H24O3S
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COMPUTED DESCRIPTORS

Molecular Weight 296.4 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 296.14461580 g/mol
Monoisotopic Mass 296.14461580 g/mol
Topological Polar Surface Area 63.8 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 331
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