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124870-33-3

124870-33-3 structural image
Product Name: Methyl 2-(3-cyanopyridin-4-yl)acetate
Formula: C9H8N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 176.17 g/mol
XLogP3 0.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 176.058577502 g/mol
Monoisotopic Mass 176.058577502 g/mol
Topological Polar Surface Area 63 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 231
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