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613222-52-9

613222-52-9 structural image
Product Name: (3E)-3-({6-[(E)-[3-(dodecanoyloxy)-2,2-dimethylpropylidene]amino]hexyl}imino)-2,2-dimethylpropyl dodecanoate
Formula: C40H76N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 649.0 g/mol
XLogP3 12.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 35
Exact Mass 648.58050891 g/mol
Monoisotopic Mass 648.58050891 g/mol
Topological Polar Surface Area 77.3 Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 711
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