CAS 80262-44-8

Cucurbituril

Description:

Cucurbituril is a class of macrocyclic compounds characterized by their unique barrel-shaped structure, which is formed by the polymerization of glycoluril units. These compounds are notable for their ability to selectively encapsulate guest molecules within their cavity, making them valuable in supramolecular chemistry and nanotechnology. Cucurbiturils exhibit a hydrophobic interior and a hydrophilic exterior, allowing them to interact favorably with a variety of organic and inorganic guest species. Their ability to form host-guest complexes is influenced by factors such as the size and shape of the guest molecule, as well as the pH and ionic strength of the surrounding environment. Additionally, cucurbiturils can participate in various chemical reactions and are being explored for applications in drug delivery, sensing, and catalysis. The compound with CAS number 80262-44-8 specifically refers to cucurbit[7]uril, which is one of the most studied members of this family, known for its relatively large cavity size and versatile binding properties.

Formula: C₃₆H₃₆N₂₄O₁₂

InChI: InChI=1S/C36H36N24O12/c61-25-37-1-38-14-16-42(26(38)62)4-46-18-20-50(30(46)66)8-54-22-24-58(34(54)70)11-57-23-21-53(33(57)69)7-49-19-17-45(29(49)65)3-41(25)15-13(37)39-2-40(14)28(64)44(16)6-48(18)32(68)52(20)10-56(22)36(72)60(24)12-59(23)35(71)55(21)9-51(19)31(67)47(17)5-43(15)27(39)63/h13-24H,1-12H2

InChI key: InChIKey=MSBXTPRURXJCPF-UHFFFAOYSA-N

SMILES: O=C1N2C3C4N5C(=O)N3CN6C7N(C2)C(=O)N8C7N(C6=O)CN9C%10N(C8)C(=O)N%11C%10N(C9=O)CN%12C%13N(C%11)C(=O)N%14CN%15C(=O)N%16CN%17C(=O)N(CN41)C%18N(C5)C(=O)N(C%18%17)CN%19C%16C%15N(C%19=O)CN(C%12=O)C%14%13

Synonyms:

• 1H,4H,14H,17H-2,16:3,15-Dimethano-5H,6H,7H,8H,9H,10H,11H,12H,13H,18H,19H,20H,21H,22H,23H,24H,25H,26H-2,3,4a,5a,6a,7a,8a,9a,10a,11a,12a,13a,15,16,17a,18a,19a,20a,21a,22a,23a,24a,25a,26a-tetracosaazabispentaleno[1′′′,6′′′:5′′,6′′,7′′]cycloocta[1′′,2′′,3′′:3′,4′]pentaleno[1′,6′:5,6,7]cycloocta[1,2,3-gh:1′,2′,3′-g'h′]cycloocta[1,2,3-cd:5,6,7-c'd′]dipentalene-1,4,6,8,10,12,14,17,19,21,23,25-dodecone, dodecahydro-
• Cucurbituril[6]
• Dodecahydro-1H,4H,14H,17H-2,16:3,15-dimethano-5H,6H,7H,8H,9H,10H,11H,12H,13H,18H,19H,20H,21H,22H,23H,24H,25H,26H-2,3,4a,5a,6a,7a,8a,9a,10a,11a,12a,13a,15,16,17a,18a,19a,20a,21a,22a,23a,24a,25a,26a-tetracosaazabispentaleno[1′′′,6′′′:5′′,6′′,7′′]cycloocta[1′′,2′′,3′′:3′,4′]pentaleno[1′,6′:5,6,7]cycloocta[1,2,3-gh:1′,2′,3′-g'h′]cycloocta[1,2,3-cd:5,6,7-c'd′]dipentalene-1,4,6,8,10,12,14,17,19,21,23,25-dodecone
• Cucurbituril

Cucurbituril

CAS: 80262-44-8

Formula: C₃₆H₃₆N₂₄O₁₂

Purity: 97%

Color and Shape: Solid

Molecular weight: 996.8246

Ref: IN-DA008N3F

Cucurbit[6]Uril Hydrate

CAS: 80262-44-8

Cucurbit[6]Uril Hydrate

Purity: 98%

Molecular weight: 996.82g/mol

Ref: 54-OR1012713

Cucurbit[6]uril

CAS: 80262-44-8

Purity: 97%

Molecular weight: 996.84

Ref: 10-F987521