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898772-90-2

898772-90-2 structural image
Product Name: 5-(1,3-DIOXOLAN-2-YL)-2-THIENYL 1-METHYLBUTYL KETONE
Formula: C13H18O3S
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COMPUTED DESCRIPTORS

Molecular Weight 254.35 g/mol
XLogP3 3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 254.09766561 g/mol
Monoisotopic Mass 254.09766561 g/mol
Topological Polar Surface Area 63.8 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 263
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