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112290-27-4

112290-27-4 structural image
Product Name: ethyl 2-amino-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carboxylate hydrochloride
Formula: C12H17ClN2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 288.79 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 288.0699267 g/mol
Monoisotopic Mass 288.0699267 g/mol
Topological Polar Surface Area 83.8 Ų
Heavy Atom Count 18
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 2
Compound Is Canonicalized Yes