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54561-69-2

54561-69-2 structural image
Product Name: 2-[(Methylthio)(phenylthio)methylene]malononitrile
Formula: C11H8N2S2
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COMPUTED DESCRIPTORS

Molecular Weight 232.3 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 232.01289061 g/mol
Monoisotopic Mass 232.01289061 g/mol
Topological Polar Surface Area 98.2 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 318
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