5-allylpyriMidine-4,6-diol

Base Information

• Chemical Name: 5-allylpyriMidine-4,6-diol
• CAS No.: 16019-30-0
• Molecular Formula: C7H8N2O2
• Molecular Weight: 152.153
• Hs Code.: 2933599090
• Mol file: 16019-30-0.mol

Synonyms:4(1H)-Pyrimidinone, 6-hydroxy-5-(2-propenyl)- (9CI);6-Hydroxy-5-(2-propen-1-yl)-4(1H)-pyrimidinone;5-Allyl-6-hydroxy-3H-pyrimidin-4-one;6-Hydroxy-5-(2-propen-1-yl)-4(3H)-pyrimidinone;4,6-Pyrimidinediol, 5-allyl- (8CI);2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(2-propenyl);5-Allyl-barbital;5-allyl-pyrimidine-2,4,6-trione;BARBITURIC ACID,5-ALLYL;4,6-Dihydroxy-5-allyl-pyrimidin;5-Allyl-2,4,6-pyrimidinetrione;5-Allylbarbituric acid;5-allylpyrimidine-4,6-diol;Deallylallobarbitone;5-Allyl-barbitursaeure;

Chemical Property of 5-allylpyriMidine-4,6-diol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 240 °C
• Boiling Point: 331.968oC at 760 mmHg
• PKA: 6.44±0.10(Predicted)
• Flash Point: 154.569oC
• PSA: 66.24000
• Density: 1.299g/cm3
• LogP: 0.61630
• Storage Temp.: 2-8°C

Purity/Quality:

97% ^*data from raw suppliers

5-ALLYLPYRIMIDINE-4,6-DIOL 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 5-allylpyriMidine-4,6-diol

There total 7 articles about 5-allylpyriMidine-4,6-diol 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: 92.0%

dimethyl allylmalonate (40637-56-7) + formamide (77287-34-4,77287-35-5,60100-09-6) → 5-(prop-2-en-1-yl)pyrimidine-4,6-diol (16019-30-0)

Guidance literature:

With sodium methylate; In methanol; at 0 - 60 ℃; for 5h;

DOI:10.1007/s10593-018-2320-0

Reference yield: 90.0%

(2-propenyl)propanedioic acid diethyl ester (2049-80-1) + formamidine hydrochloride (6313-33-3) → 6-hydroxy-5-(2-propen-1-yl)-4(1H)-pyrimidinone (16019-30-0)

Guidance literature:

formamidine hydrochloride; With sodium methylate; In methanol; at 20 ℃; for 1h;

(2-propenyl)propanedioic acid diethyl ester; In methanol; at 20 ℃; for 36h;

Reference yield: 76.0%

(2-propenyl)propanedioic acid diethyl ester (2049-80-1) + formamidine hydrochloride (6313-33-3) → 5-(prop-2-en-1-yl)pyrimidine-4,6-diol (16019-30-0)

Guidance literature:

With sodium methylate; In methanol; at 20 ℃; for 20h;

DOI:10.1021/jo900157z

upstream raw materials:

(2-propenyl)propanedioic acid diethyl ester

formamidine hydrochloride

formamidine acetic acid

formamidine

Downstream raw materials:

4-chloro-1H-pyrrolo[2,3-d]pyrimidine

2-(4,6-dichloropyrimidin-5-yl)acetaldehyde

(+/-)-1-methylethyl 4-({7-[2-fluoro-4-(methylsulfonyl)phenyl]-6-methyl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl}oxy)-1-piperidinecarboxylate

(-)-1-methylethyl 4-({7-[2-fluoro-4-(methylsulfonyl)-phenyl]-6-methyl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl}oxy)-1-piperidinecarboxylate