7-amino-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one

Base Information

• Chemical Name: 7-amino-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one
• CAS No.: 118314-12-8
• Molecular Formula: C₁₃H₁₇N₅O₃S
• Molecular Weight: 323.376
• Mol file: 118314-12-8.mol

Synonyms:7-amino-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one

Chemical Property of 7-amino-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 7-amino-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one

There total 8 articles about 7-amino-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one 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: 78.0%

7-chloro-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one (118314-15-1) → 7-amino-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one (118314-12-8)

Guidance literature:

With ammonium hydroxide; In ethanol; for 5.5h; Ambient temperature;

DOI:10.1248/cpb.40.2391

Reference yield:

7-chloro-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one (118314-15-1) → C13 H15 ClN4 O3 S.1/4H2 O + 7-amino-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one (118314-12-8)

Guidance literature:

With ammonia; In ethanol;

Reference yield:

3-cyclohexane-2-propenenitrile (6050-00-6) → 7-amino-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one (118314-12-8)

Guidance literature:

Multi-step reaction with 6 steps

1: 94.1 percent / H₂ / 5percent Pd/C / ethanol / 760 Torr

2: 83 percent / CF₃COOH

3: 81.7 percent / heptane / 2 h / 140 - 150 °C

4: 91.2 percent / fuming HNO₃, AcOH / 2.5 h / Ambient temperature

5: 96.3 percent / tripropylamine, POCl₃ / 3 h / 80 - 85 °C

6: 78 percent / concd. NH₄OH / ethanol / 5.5 h / Ambient temperature

With tri-n-propylamine; ammonium hydroxide; hydrogen; nitric acid; acetic acid; trifluoroacetic acid; trichlorophosphate; palladium on activated charcoal; In ethanol; n-heptane;

DOI:10.1248/cpb.40.2391

upstream raw materials:

7-chloro-2-(2-cyclohexylethyl)-6-nitro-5H-1,3,4-thiadiazolo<3,2-a>pyrimidin-5-one

3-cyclohexylpropionitrile

3-cyclohexane-2-propenenitrile

5-(2-cyclohexylethyl)-1,3,4-thiadiazol-2-amine