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213462-12-5

213462-12-5 structural image
Product Name: 4-(4-CHLOROPHENYL)-4,5,6,7-TETRAHYDROTHIENO[3,2-C]PYRIDINE
Formula: C13H12ClNS
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COMPUTED DESCRIPTORS

Molecular Weight 249.76 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 249.0378983 g/mol
Monoisotopic Mass 249.0378983 g/mol
Topological Polar Surface Area 40.3 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 240
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes