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338420-26-1

338420-26-1 structural image
Product Name: DIMETHYL 5-(4-CHLOROPHENYL)-4,6-DIOXOTETRAHYDRO-2H-PYRROLO[3,4-D]ISOXAZOLE-3,3(3AH)-DICARBOXYLATE
Formula: C15H13ClN2O7
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COMPUTED DESCRIPTORS

Molecular Weight 368.72 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 5
Exact Mass 368.0411285 g/mol
Monoisotopic Mass 368.0411285 g/mol
Topological Polar Surface Area 111 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 601
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes