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898772-86-6

898772-86-6 structural image
Product Name: 2,2-DIMETHYLPROPYL 5-(1,3-DIOXOLAN-2-YL)-2-THIENYL KETONE
Formula: C13H18O3S
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COMPUTED DESCRIPTORS

Molecular Weight 254.35 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
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 279
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