Cucurbit[8]uril hydrate

ALDRICH/545228 - contains acid of crystalization

Synonym: CB[8]) hydrate

MDL Number: MFCD03456501
Linear Formula: C₄₈H₄₈N₃₂O₁₆ · xH₂O · xHCl
Product Type: Chemical

Catalog Number	PKG Qty.	Price	Quantity


45-545228-100MG	100 mg	$587.00 1/EA		Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

contains	acid of crystalization
form	solid
InChI	1S/C48H48N32O16.ClH.H2O/c81-33-49-1-50-18-20-54(34(50)82)4-58-22-24-62(38(58)86)8-66-26-28-70(42(66)90)12-74-30-32-78(46(74)94)15-77-31-29-73(45(77)93)11-69-27-25-65(41(69)89)7-61-23-21-57(37(61)85)3-53(33)19-17(49)51-2-52(18)36(84)56(20)6-60(22)40(88)64(24)10-68(26)44(92)72(28)14-76(30)48(96)80(32)16-79(31)47(95)75(29)13-71(27)43(91)67(25)9-63(23)39(87)59(21)5-55(19)35(51)83;;/h17-32H,1-16H2;1H;1H2/t17-,18+,19+,20-,21-,22+,23+,24-,25-,26+,27+,28-,29-,30+,31+,32-;;
InChI key	COYIBPCTQSGIKE-IIKCYMFNSA-N
optical activity	[α]20/D −61°, c = 1% in H₂O
Quality Level	100
SMILES string	O.Cl.O=C1N2CN3C4C5N(CN6C7C8N(CN9C%10C%11N(CN%12C%13C%14N(CN%15C%16C%17N(CN%18C%19C%20N(CN%21C%22C%23N(CN1C%24C2N%25CN4C(=O)N5CN7C(=O)N8CN%10C(=O)N%11CN%13C(=O)N%14CN%16C(=O)N%17CN%19C(=O)N%20CN%22C(=O)N%23CN%24C%25=O)C%21=O)C%18=O)C%15=O)C%12=O)C9=O)C6=O)C3=O

Application:	Cucurbit[8]uril hydrate can be used as ananocontainer in a polyelectrolyte multilayer film.
General description:	Cucurbit[8]uril hydrate (CB[8]) is apumpkin-shaped macromolecule widely explored in the field of host-guestchemistry. It can form binary and ternary complexes. The carbonyl groups ofglycoluril present at rims of CB[8] act as electrostatic dipoles and make it favorable forincorporating cationic organic ammonium compounds. It can also be used toprepare stimuli-responsive polymer brushes.
Other Notes:	May contain ca.20% water. Contains acid of crystallization.
Packaging:	100 mg in glass insert

RIDADR	NONH for all modes of transport
WGK Germany	WGK 3
Flash Point(F)	Not applicable
Flash Point(C)	Not applicable

UNSPSC

12162002

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