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91553-92-3

91553-92-3 structural image
Product Name: Carbamic acid, 1-(2-propynyl)cyclooctyl ester (6CI,7CI)
Formula: C12H19NO2
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COMPUTED DESCRIPTORS

Molecular Weight 209.28 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 209.141578849 g/mol
Monoisotopic Mass 209.141578849 g/mol
Topological Polar Surface Area 52.3 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 254
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes