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828246-27-1

828246-27-1 structural image
Product Name: 3-Ethyl-3,4-dihydro-5-methoxy-3-methyl-2H-1,4-benzoxazin-2-one
Formula: C12H15NO3
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COMPUTED DESCRIPTORS

Molecular Weight 221.25 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 221.10519334 g/mol
Monoisotopic Mass 221.10519334 g/mol
Topological Polar Surface Area 47.6 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 281
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes