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68400-47-5

68400-47-5 structural image
Product Name: 2,5-Diethoxy-4-((4-methylphenyl)thio)nitrobenzene
Formula: C17H19NO4S
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COMPUTED DESCRIPTORS

Molecular Weight 333.4 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 333.10347926 g/mol
Monoisotopic Mass 333.10347926 g/mol
Topological Polar Surface Area 89.6 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 368
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