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86053-93-2

86053-93-2 structural image
Product Name: Benzeneacetonitrile, α-amino-3,4,5-trimethoxy-
Formula: C11H14N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 222.24 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 222.10044231 g/mol
Monoisotopic Mass 222.10044231 g/mol
Topological Polar Surface Area 77.5 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 249
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