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898778-19-3

898778-19-3 structural image
Product Name: 2-(3-CYANOBENZOYL)-5-(1,3-DIOXOLAN-2-YL)THIOPHENE
Formula: C15H11NO3S
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COMPUTED DESCRIPTORS

Molecular Weight 285.3 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 285.04596439 g/mol
Monoisotopic Mass 285.04596439 g/mol
Topological Polar Surface Area 87.6 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 413
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