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127274-91-3

127274-91-3 structural image
Product Name: 1,1'-DIOCTADECYL-3,3,3',3'-TETRAMETHYLINDODICARBOCYANINE PERCHLORATE
Formula: C61H99ClN2O4
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COMPUTED DESCRIPTORS

Molecular Weight 959.9 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 37
Exact Mass 958.7293373 g/mol
Monoisotopic Mass 958.7293373 g/mol
Topological Polar Surface Area 80.5 Ų
Heavy Atom Count 68
Formal Charge 0
Complexity 1280
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 3
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes