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137036-54-5

137036-54-5 structural image
Product Name: (3S)-Amino-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Formula: C10H12N2O
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COMPUTED DESCRIPTORS

Molecular Weight 176.21 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 176.094963011 g/mol
Monoisotopic Mass 176.094963011 g/mol
Topological Polar Surface Area 55.1 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 205
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes