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320424-45-1

320424-45-1 structural image
Product Name: 5-(TERT-BUTYL)-2-[(4-NITROBENZYL)OXY]ISOPHTHALONITRILE
Formula: C19H17N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 335.4 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 335.12699141 g/mol
Monoisotopic Mass 335.12699141 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 540
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