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1164546-60-4

1164546-60-4 structural image
Product Name: METHYL 3-(2-CHLOROPHENYL)-5-[2-(DIMETHYLAMINO)-1-(2-ETHOXY-2-OXOACETYL)VINYL]-4-ISOXAZOLECARBOXYLATE
Formula: C19H19ClN2O6
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COMPUTED DESCRIPTORS

Molecular Weight 406.8 g/mol
XLogP3 3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 9
Exact Mass 406.0931640 g/mol
Monoisotopic Mass 406.0931640 g/mol
Topological Polar Surface Area 98.9 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 624
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