1,3-Dimethyl-5-phenylbarbituric acid

Base Information

Chemical Name:1,3-Dimethyl-5-phenylbarbituric acid
CAS No.:7391-66-4
Molecular Formula:C12H12 N2 O3
Molecular Weight:232.239
Hs Code.:2933540000
European Community (EC) Number:230-981-2
NSC Number:125776
DSSTox Substance ID:DTXSID40995067
Nikkaji Number:J14.774E
Wikidata:Q72471210
ChEMBL ID:CHEMBL1902629
Mol file:7391-66-4.mol

Synonyms:7391-66-4;1,3-Dimethyl-5-phenylbarbituric acid;1,3-dimethyl-5-phenylpyrimidine-2,4,6(1h,3h,5h)-trione;1,3-dimethyl-5-phenyl-1,3-diazinane-2,4,6-trione;EINECS 230-981-2;NSC 125776;BRN 0217726;Barbituric acid, 1,3-dimethyl-5-phenyl-;5-Phenyl-1,3-dimethyl-barbituric acid;1,3-dimethyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione;2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-dimethyl-5-phenyl-;(5-PHENYL-1,3-DIMETHYL)BARBITURIC ACID;SCHEMBL64294;MLS001180960;CHEMBL1902629;DTXSID40995067;HMS2804H24;5-Phenyl-1,3-dimethylbarbituricacid;NSC125776;AKOS015918170;Barbituric acid,3-dimethyl-5-phenyl-;NSC-125776;LS-24236;SMR000475678;AB-323/13887085;2,6(1H,3H,5H)-Pyrimidinetrione, 1,3-dimethyl-5-phenyl-

Suppliers and Price of 1,3-Dimethyl-5-phenylbarbituric 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

Chemenu
1,3-dimethyl-5-phenylpyrimidine-2,4,6(1H,3H,5H)-trione 95%
5g
$ 617.00

American Custom Chemicals Corporation
1,3-DIMETHYL-5-PHENYLBARBITURIC ACID 95.00%
5G
$ 1394.66

Total 13 raw suppliers

Chemical Property of 1,3-Dimethyl-5-phenylbarbituric acid

Chemical Property:

Vapor Pressure:3.78E-05mmHg at 25°C
Melting Point:140.0-140.5 °C
Boiling Point:352.7°Cat760mmHg
PKA:4.41±0.20(Predicted)
Flash Point:155.2°C
PSA：57.69000
Density:1.274g/cm³
LogP:0.69640
XLogP3:0.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:232.08479225
Heavy Atom Count:17
Complexity:337

Purity/Quality:

97% ^*data from raw suppliers

1,3-dimethyl-5-phenylpyrimidine-2,4,6(1H,3H,5H)-trione 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C(=O)C(C(=O)N(C1=O)C)C2=CC=CC=C2

Technology Process of 1,3-Dimethyl-5-phenylbarbituric acid

There total 7 articles about 1,3-Dimethyl-5-phenylbarbituric 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: 90.0%

: 108-86-1,52753-63-6
bromobenzene

: 769-42-6
1,3-dimethylbarbituric acid

: 7391-66-4
1,3-dimethyl-5-phenyl-pyrimidine-2,4,6(1H,3H,5H)-trione

Guidance literature:: With ytterbium(III) chloride; In ethanol; at 20 ℃; for 10h;

Reference yield: 77.0%

: 74808-90-5
5-diazo-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

: 71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1
benzene

: 7391-66-4
1,3-dimethyl-5-phenyl-pyrimidine-2,4,6(1H,3H,5H)-trione

Guidance literature:: With bis{rhodium[3,3'-(1,3-phenylene)bis(2,2-dimethylpropanoic acid)]}; at 20 ℃; for 24h; regioselective reaction;
DOI:10.1002/anie.201502324