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108446-73-7

108446-73-7 structural image
Product Name: 3-[3-(4-BROMO-PHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]-ACRYLIC ACID
Formula: C18H13BrN2O2
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COMPUTED DESCRIPTORS

Molecular Weight 369.2 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 368.01604 g/mol
Monoisotopic Mass 368.01604 g/mol
Topological Polar Surface Area 55.1 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 429
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes