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12239-15-5

12239-15-5 structural image
Product Name: Acid Yellow 49
Formula: C16H13Cl2N5O3S
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COMPUTED DESCRIPTORS

Molecular Weight 426.3 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 4
Exact Mass 425.0116159 g/mol
Monoisotopic Mass 425.0116159 g/mol
Topological Polar Surface Area 131 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 641
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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