Cucurbituril

Base Information

Chemical Name:Cucurbituril
CAS No.:80262-44-8
Molecular Formula:C36H36N24O12
Molecular Weight:996.835
Hs Code.:
European Community (EC) Number:805-571-7
DSSTox Substance ID:DTXSID101317823
Nikkaji Number:J1.139.200H
Wikidata:Q413979,Q27122602
Metabolomics Workbench ID:57744
Mol file:80262-44-8.mol

Synonyms:cucurbit(6)uril

Suppliers and Price of Cucurbituril

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

AK Scientific
Cucurbituril
5g
$ 681.00

Ambeed
Cucurbituril 98%
250mg
$ 39.00

Ambeed
Cucurbituril 98%
1g
$ 85.00

Ambeed
Cucurbituril 98%
5g
$ 320.00

American Custom Chemicals Corporation
CUCURBITURIL 95.00%
5MG
$ 500.65

Arctom
Cucurbituril ≥95%
5g
$ 460.00

Crysdot
Cucurbituril 95+%
5g
$ 480.00

JR MediChem
cucurbit[6]uril 98%
25g
$ 680.00

JR MediChem
cucurbit[6]uril 98%
100g
$ 1680.00

JR MediChem
cucurbit[6]uril 98%
5g
$ 188.00

Total 38 raw suppliers

Chemical Property of Cucurbituril

Chemical Property:

Melting Point:-470oC
Boiling Point:°Cat760mmHg
PKA:0.02±0.20(Predicted)
Flash Point:°C
PSA：282.60000
Density:2.66g/cm³
LogP:-7.15440
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:-6.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:0
Exact Mass:996.29445268
Heavy Atom Count:72
Complexity:2140

Purity/Quality:

99%, ^*data from raw suppliers

Cucurbituril ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)CN5C%13C(N1C5=O)N1CN3C(=O)N4CN6C(=O)N7CN9C(=O)N2CN8C(=O)N%10CN%11C(=O)N%12CN%13C1=O

Technology Process of Cucurbituril

There total 33 articles about Cucurbituril which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 30.0%

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 101241-21-8
3a,6a-diphenylglycoluril

: 496-46-8,117911-83-8
glycouril

: 80262-44-8
cucurbituril

: diphenyl cucurbit[6]uril

Guidance literature:: With ammonium sulfate; sulfuric acid; at 70 - 95 ℃; for 36h;
DOI:10.1021/ol025749o

Reference yield:

: C₃₆H₃₆N₂₄O₁₂*C₇H₁₅N

: 80262-44-8
cucurbituril

: 3218-02-8
cyclohexylmethylamine

Guidance literature:: With formic acid; sodium sulfate; In water-d2; at 40 ℃; pH=7.0; Further Variations:; pH-values; Equilibrium constant;
DOI:10.1002/1521-3773(20010903)40:17<3155::AID-ANIE3155>3.0.CO;2-7