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5634-41-3

5634-41-3 structural image
Product Name: parapenzolate bromide
Formula: C21H26NO3.Br
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COMPUTED DESCRIPTORS

Molecular Weight 420.3 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 419.10961 g/mol
Monoisotopic Mass 419.10961 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 422
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 2
Compound Is Canonicalized Yes