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103049-97-4

103049-97-4 structural image
Product Name: 2,3-BIS(N-OCTYLTHIO)-1,4-NAPHTHALENEDIONE
Formula: C26H38O2S2
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COMPUTED DESCRIPTORS

Molecular Weight 446.7 g/mol
XLogP3 9.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 16
Exact Mass 446.23132280 g/mol
Monoisotopic Mass 446.23132280 g/mol
Topological Polar Surface Area 84.7 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 507
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