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91090-86-7

91090-86-7 structural image
Product Name: ETHYL 2-CYANO-2-(4-NITROPHENYL)ACETATE
Formula: C11H10N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 234.21 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 234.06405680 g/mol
Monoisotopic Mass 234.06405680 g/mol
Topological Polar Surface Area 95.9 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 333
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