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53847-49-7

53847-49-7 structural image
Product Name: DIMETHYL-3-METHYL-ISOXAZOLE-4,5-DICARBOXYLATE
Formula: C8H9NO5
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COMPUTED DESCRIPTORS

Molecular Weight 199.16 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 199.04807239 g/mol
Monoisotopic Mass 199.04807239 g/mol
Topological Polar Surface Area 78.6 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 242
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