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80012-69-7

80012-69-7 structural image
Product Name: 11H-Dibenzo[b,e]azepine-6-carbonitrile
Formula: C15H10N2
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COMPUTED DESCRIPTORS

Molecular Weight 218.25 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 218.084398327 g/mol
Monoisotopic Mass 218.084398327 g/mol
Topological Polar Surface Area 36.2 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 362
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 1
Compound Is Canonicalized Yes