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898772-47-9

898772-47-9 structural image
Product Name: 4-CHLOROBUTYL 5-(1,3-DIOXOLAN-2-YL)-2-THIENYL KETONE
Formula: C12H15ClO3S
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COMPUTED DESCRIPTORS

Molecular Weight 274.76 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 274.0430432 g/mol
Monoisotopic Mass 274.0430432 g/mol
Topological Polar Surface Area 63.8 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 256
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