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Captisol

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Captisol / CAS : 182410-00-0

Appearance White to off white Solid powder UN 0.0
HS 35051000 DG Class 0.0
Synonyms .Beta.-Cyclodextrin, Sulfobutyl Ethers, Sodium Salts; Sbe-β-Cd(Sulfobutyl Ether-β-Cyclodextrin Sodium Salt); Betadex Sulfobutyl Ether Soidum; Sulfobutyl Ether Sodium Salt; Betadex Sulfobuytl Ether Sodium; β-Cyclodextrin, Sulfobutyl Ethers; β-Cyclodextrin, Sulfobutyl Ethers, Sodium Salts; Sulfobutylated Beta-Cyclodextrin Sodium Salt; Sodium Sulphobutylether-beta-Cyclodextrin; SBE-Beta-CD; A-CD;; SBE-;
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Properties

Summary

Formula
C42H70O35
Molecular Mass
1451.29000
Exact Mass
1450.37000
PSA
663.21000
Logp
-12.36960
IUPAC
[[(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18S,20S,21R,23S,25S,26R,28S,30S,31R,33R,35R,36R,37R,38S,39S,40S,41S,42S,43S,44R,45R,46S,47R,48R,49R)-36,37,38,39,40,41,42,43,44,45,46,48,49-tridecahydroxy-5,15,20,25,30,35-hexakis(hydroxymethyl)-47-(4-sulfonatobutoxy)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-10-yl]methoxy]butane-1-sulfonate
SMILES
C(CCS(=O)(=O)[O-])COCC1C2C(C(C(O1)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)OC5C(OC(C(C5O)O)OC6C(OC(C(C6O)O)OC7C(OC(C(C7O)O)OC8C(OC(O2)C(C8O)O)CO)CO)CO)CO)CO)CO)OCCCCS(=O)(=O)[O-])O.[Na+].[Na+]

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Specialty Drugs
Food(Feed) Additives > Nutritional Fortifier

Chemical and Physical Properties

Appearance
White to off white Solid powder

Export information

HS Code
35051000
Export Rebate
13%
UN No.
0.0
DG-Class
0.0

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