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72030-16-1

72030-16-1 structural image
Product Name: SPECS AQ-405/40000809
Formula: C13H9NS
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COMPUTED DESCRIPTORS

Molecular Weight 211.28 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 211.04557046 g/mol
Monoisotopic Mass 211.04557046 g/mol
Topological Polar Surface Area 52 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 280
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes