C₁₃H₁₅O₃N₃S

Base Information

• Chemical Name: C₁₃H₁₅O₃N₃S
• CAS No.: 936336-96-8
• Molecular Formula: C₁₃H₁₅N₃O₃S
• Molecular Weight: 293.346
• Mol file: 936336-96-8.mol

Synonyms:C₁₃H₁₅O₃N₃S

Chemical Property of C₁₃H₁₅O₃N₃S

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of C₁₃H₁₅O₃N₃S

There total 10 articles about C₁₃H₁₅O₃N₃S 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: 90.0%

(N,N-dimethyl)-[5-(3-hydroxymethylbenzyl)-imidazole]-1-sulfonamide (936336-94-6) → C13H15O3N3S (936336-96-8)

Guidance literature:

With oxalyl dichloride; dimethyl sulfoxide; triethylamine; In dichloromethane; at -78 - -20 ℃; for 2h;

DOI:10.1021/jm0613469

Reference yield:

benzene 1,3-dicarboxylic acid monomethyl ester (1877-71-0) → C13H15O3N3S (936336-96-8)

Guidance literature:

Multi-step reaction with 8 steps

1.1: 92 percent / BF₃*THF / tetrahydrofuran / 0.75 h / 20 °C

2.1: 93 percent / pyridine / DMAP; pyridine p-toluenesulfonate / CH₂Cl₂ / 1 h / 20 °C

3.1: 88 percent / LiAlH₄ / tetrahydrofuran / 2 h / Heating

4.1: 63 percent / mesyl chloride; NEt₃ / 20 °C

5.1: 92 percent / NaI / acetone / 72 h / 20 °C

6.1: n-BuLi / tetrahydrofuran; hexane / 0.5 h / -78 °C

6.2: 48 percent / tetrahydrofuran; hexane / -78 - 20 °C

7.1: 83 percent / tetrabutylammonium fluoride / tetrahydrofuran / 4 h / 20 - 40 °C

8.1: 90 percent / oxalyl chloride; NEt₃; DMSO / CH₂Cl₂ / 2 h / -78 - -20 °C

With pyridine; lithium aluminium tetrahydride; n-butyllithium; oxalyl dichloride; boron trifluoride-tetrahydrofuran complex; tetrabutyl ammonium fluoride; dimethyl sulfoxide; methanesulfonyl chloride; triethylamine; sodium iodide; dmap; pyridinium p-toluenesulfonate; In tetrahydrofuran; hexane; dichloromethane; acetone; 8.1: Swern oxidation;

DOI:10.1021/jm0613469

Reference yield:

methyl 3-(hydroxymethyl)benzoate (67853-03-6) → C13H15O3N3S (936336-96-8)

Guidance literature:

Multi-step reaction with 7 steps

1.1: 93 percent / pyridine / DMAP; pyridine p-toluenesulfonate / CH₂Cl₂ / 1 h / 20 °C

2.1: 88 percent / LiAlH₄ / tetrahydrofuran / 2 h / Heating

3.1: 63 percent / mesyl chloride; NEt₃ / 20 °C

4.1: 92 percent / NaI / acetone / 72 h / 20 °C

5.1: n-BuLi / tetrahydrofuran; hexane / 0.5 h / -78 °C

5.2: 48 percent / tetrahydrofuran; hexane / -78 - 20 °C

6.1: 83 percent / tetrabutylammonium fluoride / tetrahydrofuran / 4 h / 20 - 40 °C

7.1: 90 percent / oxalyl chloride; NEt₃; DMSO / CH₂Cl₂ / 2 h / -78 - -20 °C

With pyridine; lithium aluminium tetrahydride; n-butyllithium; oxalyl dichloride; tetrabutyl ammonium fluoride; dimethyl sulfoxide; methanesulfonyl chloride; triethylamine; sodium iodide; dmap; pyridinium p-toluenesulfonate; In tetrahydrofuran; hexane; dichloromethane; acetone; 7.1: Swern oxidation;

DOI:10.1021/jm0613469

upstream raw materials:

(N,N-dimethyl)-[5-(3-hydroxymethylbenzyl)-imidazole]-1-sulfonamide

N,N-dimethyl-(2-triisopropylsilanylimidazole)-1-sulfonamide

methyl 3-(triisopropylsilanyloxymethyl)benzoate

((3-(chloromethyl)benzyl)oxy)triisopropylsilane

Downstream raw materials:

3-(dimethylsulfamoyl-3H-imidazol-4-ylmethyl)-benzoic acid