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1622335-41-4

1622335-41-4 structural image
Product Name: ICG-Alkyne
Formula: C48H53N3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 768.0 g/mol
XLogP3 9.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 15
Exact Mass 767.37567835 g/mol
Monoisotopic Mass 767.37567835 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 56
Formal Charge 0
Complexity 1670
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 4
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes