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898759-94-9

898759-94-9 structural image
Product Name: 3-CYANO-4'-(1,3-DIOXOLAN-2-YL)BENZOPHENONE
Formula: C17H13NO3
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COMPUTED DESCRIPTORS

Molecular Weight 279.29 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 279.08954328 g/mol
Monoisotopic Mass 279.08954328 g/mol
Topological Polar Surface Area 59.3 Ų
Heavy Atom Count 21
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