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898771-86-3

898771-86-3 structural image
Product Name: BUTYL 5-(1,3-DIOXOLAN-2-YL)-2-THIENYL KETONE
Formula: C12H16O3S
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COMPUTED DESCRIPTORS

Molecular Weight 240.32 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 240.08201554 g/mol
Monoisotopic Mass 240.08201554 g/mol
Topological Polar Surface Area 63.8 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 238
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