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869496-61-7

869496-61-7 structural image
Product Name: 3-(2-BROMO-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE
Formula: C10H6BrNO2
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COMPUTED DESCRIPTORS

Molecular Weight 252.06 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 250.95819 g/mol
Monoisotopic Mass 250.95819 g/mol
Topological Polar Surface Area 43.1 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 212
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