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886840-56-8

886840-56-8 structural image
Product Name: RED-CLA [CHEMILUMINESCENCE REAGENT]
Formula: C50H51N7O9S2
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COMPUTED DESCRIPTORS

Molecular Weight 958.1 g/mol
XLogP3 4.5
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 12
Exact Mass 957.31896858 g/mol
Monoisotopic Mass 957.31896858 g/mol
Topological Polar Surface Area 224 Ų
Heavy Atom Count 68
Formal Charge 0
Complexity 2210
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