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119931-48-5

119931-48-5 structural image
Product Name: 3,6-BIS(DECYL)PHTHALONITRILE
Formula: C28H44N2
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COMPUTED DESCRIPTORS

Molecular Weight 408.7 g/mol
XLogP3 11.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 18
Exact Mass 408.350449412 g/mol
Monoisotopic Mass 408.350449412 g/mol
Topological Polar Surface Area 47.6 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 447
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