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138716-53-7

138716-53-7 structural image
Product Name: 2-[(DIMETHYLAMINO)METHYLENE]-3-(4-BIPHENYLYL)-3-OXO-PROPANENITRILE
Formula: C18H16N2O
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COMPUTED DESCRIPTORS

Molecular Weight 276.3 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 276.126263138 g/mol
Monoisotopic Mass 276.126263138 g/mol
Topological Polar Surface Area 44.1 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 429
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes