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5275-11-6

5275-11-6 structural image
Product Name: 3-AMINO-4-CYANO-5,6,7,8-TETRAHYDRO-1H-2-BENZOTHIOPYRAN-1-THIONE
Formula: C10H10N2S2
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COMPUTED DESCRIPTORS

Molecular Weight 222.3 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 222.02854067 g/mol
Monoisotopic Mass 222.02854067 g/mol
Topological Polar Surface Area 107 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 409
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