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123172-58-7

123172-58-7 structural image
Product Name: (E)-7-(1-Oxo-3-phenyl-2-propenyl)-2,2,4-trimethyl-2H-1,4-benzoxazin-3( 4H)-one
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COMPUTED DESCRIPTORS

Molecular Weight 321.4 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 321.13649347 g/mol
Monoisotopic Mass 321.13649347 g/mol
Topological Polar Surface Area 46.6 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 519
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes