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6,6'-Dibehenoyl-Alpha,Alpha'-Trehalose

6,6'-Dibehenoyl-Alpha,Alpha'-Trehalose / CAS : 66758-35-8

Appearance - UN -
HS 29171900 DG Class -
Synonyms 6,6'-Dibehenoyl-α,α'-Trehalose; 6-O-(1-Oxodocosyl)-Alpha-D-Glucopyranosylalpha-D-Glucopyranoside6-Docosanoate; Trehalose6,6'-Dibehenate; 22:0Trehalose; D-(+)-Trehalose6,6'-Dibehenate;22:0Trehalose; α-D-Glucopyranoside,6-O-(1-Oxodocosyl)-α-D-Glucopyranosyl,6-Docosanoate; ((2R,2'R,3S,3'S,4S,4'S,5R,5'R,6R,6'R)-6,6'-Oxybis(3,4,5-Trihydroxytetrahydro-2H-Pyran-6,2-diyl))bis(Methylene)Didocosanoate; Alpha-D-Glucopyranoside6-O-(1-Oxodocosyl)-Alpha-D-Glucopyranosyl6-Docosanoate
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Properties

Summary

Formula
C56H106O13
Molecular Mass
987.43300
Exact Mass
986.76300
PSA
201.67000
Logp
11.34840
IUPAC
[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5S,6R)-6-(docosanoyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl docosanoate
SMILES
CCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)CCCCCCCCCCCCCCCCCCCCC)O)O)O)O)O)O

Chemical and Physical Properties

Density
1.08±0.1 g/cm3(Predicted)
Boiling Point
945.8±65.0 °C(Predicted)

Export information

HS Code
29171900
Export Rebate
13%

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