5-prop-2-enyl-1H-pyrimidine-2,4-dione

Base Information

Chemical Name:5-prop-2-enyl-1H-pyrimidine-2,4-dione
CAS No.:59090-35-6
Molecular Formula:C₇H₈N₂O₂
Molecular Weight:152.153
Hs Code.:
NSC Number:81160
DSSTox Substance ID:DTXSID90292250
Nikkaji Number:J2.460.541H
Wikidata:Q82030480
Mol file:59090-35-6.mol

Synonyms:5-allyluracil;59090-35-6;5-prop-2-enyl-1H-pyrimidine-2,4-dione;NSC81160;SCHEMBL175877;DTXSID90292250;VOBFOFTXJVSVTJ-UHFFFAOYSA-N;CCG-40414;NSC-81160

Suppliers and Price of 5-prop-2-enyl-1H-pyrimidine-2,4-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 7 raw suppliers

Chemical Property of 5-prop-2-enyl-1H-pyrimidine-2,4-dione

Chemical Property:

Refractive Index:1.498
PSA：65.72000
Density:1.152 g/cm³
LogP:-0.20830
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:152.058577502
Heavy Atom Count:11
Complexity:243

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=CCC1=CNC(=O)NC1=O

Technology Process of 5-prop-2-enyl-1H-pyrimidine-2,4-dione

There total 4 articles about 5-prop-2-enyl-1H-pyrimidine-2,4-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: 84.0%

: 696-07-1
5-iodouracil

: 106-95-6
allyl bromide

: 59090-35-6
5-allylpyrimidine-2,4(1H,3H)-dione

Guidance literature:: 5-iodouracil; With methylmagnesium chloride; lithium chloride; In tetrahydrofuran; at -20 ℃; for 0.333333h;

With TurboGrignard; In tetrahydrofuran; at 20 ℃; for 1h;

allyl bromide; CuCN*2LiCl; In tetrahydrofuran; at -20 - 20 ℃; Further stages.;
DOI:10.1021/ol063136w

Reference yield:

Li₂ PdCl₄: Li₂ PdCl₄

: 7783-06-4
hydrogen sulfide

: 66-22-8,144104-68-7,18324-22-6,27072-01-1,2920-92-5,51953-19-6
uracil

: 107-05-1
3-chloroprop-1-ene

: 59090-35-6
5-allylpyrimidine-2,4(1H,3H)-dione

Guidance literature:: With sodium chloride; Hg(OAc)2; In water; acetonitrile;

Reference yield:

: 66-22-8,144104-68-7,18324-22-6,27072-01-1,2920-92-5,51953-19-6
uracil

: 107-05-1
3-chloroprop-1-ene

: 59090-35-6
5-allylpyrimidine-2,4(1H,3H)-dione

Guidance literature:: With lithium tetrachloropalladate(II); mercury(II) diacetate; Yield given. Multistep reaction; 1.) H₂O, 70 deg C, 7 d, 2.) CH₃CN, RT, 7 d;
DOI:10.1021/jm950029r