6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione

Base Information

Chemical Name:6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione
CAS No.:13441-90-2
Molecular Formula:C11H9BrN2O2
Molecular Weight:281.1054
Hs Code.:
NSC Number:104461
DSSTox Substance ID:DTXSID80295699
Nikkaji Number:J2.808.330K
Wikidata:Q82035768
Mol file:13441-90-2.mol

Synonyms:13441-90-2;6-benzyl-5-bromopyrimidine-2,4(1h,3h)-dione;6-benzyl-5-bromo-1H-pyrimidine-2,4-dione;2,4(1H,3H)-Pyrimidinedione, 5-bromo-6-(phenylmethyl)-;NSC104461;NCIOpen2_007058;DTXSID80295699;NSC-104461

Suppliers and Price of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione

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

Total 5 raw suppliers

Chemical Property of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
Density:1.62g/cm³
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:279.98474
Heavy Atom Count:16
Complexity:346

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CC2=C(C(=O)NC(=O)N2)Br

Technology Process of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione

There total 3 articles about 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione 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: 77.0%

: 13345-11-4
6-benzyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

: 13441-90-2
6-benzyl-5-bromopyrimidine-2,4(1H,3H)-dione

Guidance literature:: With N-Bromosuccinimide; dibenzoyl peroxide; In ethanol; at 20 ℃; for 5h;
DOI:10.1002/jhet.239

Reference yield:

: 718-08-1
ethyl 3-oxo-4-phenylbutyrate

: 13441-90-2
6-benzyl-5-bromopyrimidine-2,4(1H,3H)-dione

Guidance literature:: Multi-step reaction with 3 steps

1: ethanolic sodium ethylate

2: aqueous chloroacetic acid

3: acetic acid; bromine

With bromine; sodium ethanolate; acetic acid; chloroacetic acid;
DOI:10.1021/ja01279a032

Reference yield:

: 140-29-4
phenylacetonitrile

: 13441-90-2
6-benzyl-5-bromopyrimidine-2,4(1H,3H)-dione

Guidance literature:: Multi-step reaction with 4 steps

1: zinc / tetrahydrofuran / 1.17 h / Reflux

2: sodium / ethanol / 4 h / Reflux

3: chloroacetic acid / water / 24 h / Reflux

4: bromine; lead dioxide; acetic acid / 12 h / 50 °C

With bromine; sodium; lead dioxide; acetic acid; chloroacetic acid; zinc; In tetrahydrofuran; ethanol; water;
DOI:10.1021/jm201506e