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30124-94-8

30124-94-8 structural image
Product Name: Disperse Red 82
Formula: C21H21N5O6
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COMPUTED DESCRIPTORS

Molecular Weight 439.4 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 11
Exact Mass 439.14918341 g/mol
Monoisotopic Mass 439.14918341 g/mol
Topological Polar Surface Area 150 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 702
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

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