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885273-64-3

885273-64-3 structural image
Product Name: 3-(2-BROMO-PHENYL)-ISOXAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
Formula: C12H10BrNO3
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COMPUTED DESCRIPTORS

Molecular Weight 296.12 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 294.98441 g/mol
Monoisotopic Mass 294.98441 g/mol
Topological Polar Surface Area 52.3 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 275
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