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Homecas898787-03-6

898787-03-6

898787-03-6 structural image
Product Name: 2,5-DIMETHOXYBENZOYLACETONITRILE
Formula: C11H11NO3
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COMPUTED DESCRIPTORS

Molecular Weight 205.21 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 205.07389321 g/mol
Monoisotopic Mass 205.07389321 g/mol
Topological Polar Surface Area 59.3 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 268
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