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116617-18-6

116617-18-6 structural image
Product Name: METHYL 3-AMINO-1-CYANO-1-PHENYL-1H-INDENE-2-CARBOXYLATE
Formula: C18H14N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 290.3 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 290.105527694 g/mol
Monoisotopic Mass 290.105527694 g/mol
Topological Polar Surface Area 76.1 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 539
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 1
Compound Is Canonicalized Yes