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39562-22-6

39562-22-6 structural image
Product Name: 2-Methoxyethyl 2-[(3-nitrophenyl)methylene]acetoacetate
Formula: C14H15NO6
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COMPUTED DESCRIPTORS

Molecular Weight 293.27 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 293.08993720 g/mol
Monoisotopic Mass 293.08993720 g/mol
Topological Polar Surface Area 98.4 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 426
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

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