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1155814-17-7

1155814-17-7 structural image
Product Name: Diethyl 5,5'-((3,6,10,11-tetrakis(pentyloxy)triphenylene-2,7-diyl)bis(oxy))dipentanoate
Formula: C52H76O10
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COMPUTED DESCRIPTORS

Molecular Weight 861.2 g/mol
XLogP3 13.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 36
Exact Mass 860.54384862 g/mol
Monoisotopic Mass 860.54384862 g/mol
Topological Polar Surface Area 108 Ų
Heavy Atom Count 62
Formal Charge 0
Complexity 1080
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