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83881-48-5

83881-48-5 structural image
Product Name: Cetirizine methyl ester 2HCl
Formula: C22H28Cl2N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 475.8 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 9
Exact Mass 474.124376 g/mol
Monoisotopic Mass 474.124376 g/mol
Topological Polar Surface Area 42 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 457
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 3
Compound Is Canonicalized Yes