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198419-09-9

198419-09-9 structural image
Product Name: ETHYL 4-OXO-3-AZEPANECARBOXYLATE HCL
Formula: C9H16ClNO3
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COMPUTED DESCRIPTORS

Molecular Weight 221.68 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 221.0818711 g/mol
Monoisotopic Mass 221.0818711 g/mol
Topological Polar Surface Area 55.4 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 203
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 2
Compound Is Canonicalized Yes