5,5-Dibutylbarbituric acid

Base Information

Chemical Name:5,5-Dibutylbarbituric acid
CAS No.:17013-41-1
Molecular Formula:C12H20 N2 O3
Molecular Weight:240.302
Hs Code.:2933540000
European Community (EC) Number:241-088-2
DSSTox Substance ID:DTXSID90168805
Nikkaji Number:J54.555D
Wikidata:Q83038420
ChEMBL ID:CHEMBL3276731
Mol file:17013-41-1.mol

Synonyms:5,5-Dibutylbarbituric acid;Dibutylbarbituric acid;17013-41-1;5,5-dibutyl-1,3-diazinane-2,4,6-trione;BARBITURIC ACID, 5,5-DIBUTYL-;2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-dibutyl-;EINECS 241-088-2;BRN 0228080;5,5-Dibutyl-2,4,6(1H,3H,5H)-pyrimidinetrione;SCHEMBL1683293;CHEMBL3276731;DTXSID90168805;LS-24132

Suppliers and Price of 5,5-Dibutylbarbituric acid

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

American Custom Chemicals Corporation
5,5-DIBUTYLBARBITURIC ACID 95.00%
5MG
$ 500.13

Total 5 raw suppliers

Chemical Property of 5,5-Dibutylbarbituric acid

Chemical Property:

Refractive Index:1.4760 (estimate)
Boiling Point:°Cat760mmHg
Flash Point:°C
PSA：82.25000
Density:1.055g/cm³
LogP:2.27100
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:240.14739250
Heavy Atom Count:17
Complexity:296

Purity/Quality:

99% ^*data from raw suppliers

5,5-DIBUTYLBARBITURIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC1(C(=O)NC(=O)NC1=O)CCCC

Technology Process of 5,5-Dibutylbarbituric acid

There total 3 articles about 5,5-Dibutylbarbituric acid 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: 68.0%

: 596-75-8
diethyl dibutylmalonate

: 57-13-6
urea

: 17013-41-1
5,5-di-n-butylbarbituric acid

Guidance literature:: With sodium ethanolate; In ethanol; for 8h; Heating;
DOI:10.1002/jps.2600771105

Reference yield:

: 133-08-4
diethyl butylmalonate

: 17013-41-1
5,5-di-n-butylbarbituric acid

Guidance literature:: Multi-step reaction with 2 steps

1: 78 percent / NaOEt / ethanol / 8 h / Heating

2: 68 percent / NaOEt / ethanol / 8 h / Heating

With sodium ethanolate; In ethanol;
DOI:10.1002/jps.2600771105