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143269-96-9

143269-96-9 structural image
Product Name: 5-(3-ETHYL-5-METHYLBENZTHIAZOLIN-2-YLIDEN)-DIMETHIN-4',5'-DIPHENYL-3'-ETHYLTHIAZOLO-ETHYL-4-OXATHIAZOLIDINO-MONOMETHINCYANIN-IODIDE
Formula: C35H34IN3OS3
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COMPUTED DESCRIPTORS

Molecular Weight 737.8 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 737.10652 g/mol
Monoisotopic Mass 737.10652 g/mol
Topological Polar Surface Area 106 Ų
Heavy Atom Count 43
Formal Charge 0
Complexity 1150
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes