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2567200-14-8

2567200-14-8 structural image
Product Name: 4,7,10,13,16,19,22,25,28,31,34,37,40,43,46,49,52,55,58,61,64,67,70,73,76-Pentacosaoxanonaheptacontanedioic acid
Formula: C54H106O29
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COMPUTED DESCRIPTORS

Molecular Weight 1219.4 g/mol
XLogP3 -4.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 29
Rotatable Bond Count 78
Exact Mass 1218.68197734 g/mol
Monoisotopic Mass 1218.68197734 g/mol
Topological Polar Surface Area 305 Ų
Heavy Atom Count 83
Formal Charge 0
Complexity 1120
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