Uracil, 5-allyl-3,6-dimethyl-

Base Information

• Chemical Name: Uracil, 5-allyl-3,6-dimethyl-
• CAS No.: 90437-63-1
• Molecular Formula: C₉H₁₂N₂O₂
• Molecular Weight: 180.206
• DSSTox Substance ID: DTXSID90238173
• Nikkaji Number: J96.599E
• Wikidata: Q83120437
• Mol file: 90437-63-1.mol

Synonyms:5-Allyl-3,6-dimethyluracil;Uracil, 5-allyl-3,6-dimethyl-;90437-63-1;BRN 0145583;5-Allyl-3,6-dimethylpyrimidine-2,4(1H,3H)-dione;DTXSID90238173;LS-158532

Chemical Property of Uracil, 5-allyl-3,6-dimethyl-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 55.12000
• Density: 1.092g/cm³
• LogP: 0.52280
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 180.089877630
• Heavy Atom Count: 13
• Complexity: 305

Purity/Quality:

5-ALLYL-3,6-DIMETHYLURACIL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=O)N(C(=O)N1)C)CC=C

Technology Process of Uracil, 5-allyl-3,6-dimethyl-

There total 2 articles about Uracil, 5-allyl-3,6-dimethyl- 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:

5-allyl-3,6-dimethyl-2-methylsulfanyl-3H-pyrimidin-4-one (90873-05-5) → 5-allyl-3,6-dimethyl-1H-pyrimidine-2,4-dione (90437-63-1)

Guidance literature:

With hydrogenchloride;

Reference yield:

5-allyl-6-methyl-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one (102613-14-9) → 5-allyl-3,6-dimethyl-1H-pyrimidine-2,4-dione (90437-63-1)

Guidance literature:

Multi-step reaction with 2 steps

1: aq. NaOH solution / beim Erwaermen<0.5 h>

2: aqueous HCl

With hydrogenchloride; sodium hydroxide;

upstream raw materials:

5-allyl-3,6-dimethyl-2-methylsulfanyl-3H-pyrimidin-4-one

5-allyl-6-methyl-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one