5-(3-chlorophenethylsulfonyl)-1-phenyl-1H-tetrazole

Base Information

• Chemical Name: 5-(3-chlorophenethylsulfonyl)-1-phenyl-1H-tetrazole
• CAS No.: 1174193-87-3
• Molecular Formula: C15H13ClN4O2S
• Molecular Weight: 348.80732
• Mol file: 1174193-87-3.mol

Synonyms:5-(3-chlorophenethylsulfonyl)-1-phenyl-1H-tetrazole

Chemical Property of 5-(3-chlorophenethylsulfonyl)-1-phenyl-1H-tetrazole

Chemical Property:

• Boiling Point: 609.1±65.0 °C(Predicted)
• PKA: -0.90±0.10(Predicted)
• PSA: 103.19000
• Density: 1.50±0.1 g/cm3(Predicted)
• LogP: 3.05310

Purity/Quality:

95+% ^*data from raw suppliers

5-((3-Chlorophenethyl)sulfonyl)-1-phenyl-1H-tetrazole 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 5-(3-chlorophenethylsulfonyl)-1-phenyl-1H-tetrazole

There total 1 articles about 5-(3-chlorophenethylsulfonyl)-1-phenyl-1H-tetrazole 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:

C15H11ClN4OS (879861-08-2) → 1-(3-chlorophenyl)-2-(1-phenyl-1H-tetrazole-5-sulfonyl)ethanone (1174193-87-3)

Guidance literature:

With 3-chloro-benzenecarboperoxoic acid; In dichloromethane;

DOI:10.1021/ja903920j

Reference yield:

trans-2-pentenal (1576-87-0) + 1-(3-chlorophenyl)-2-(1-phenyl-1H-tetrazole-5-sulfonyl)ethanone (1174193-87-3) → (R,E)-5-(3-chlorophenyl)-3-ethylpent-4-yn-1-ol (1174194-17-2) + (Z)-5-(3-chlorophenyl)-3-ethylpent-4-yn-1-ol

Guidance literature:

trans-2-pentenal; 1-(3-chlorophenyl)-2-(1-phenyl-1H-tetrazole-5-sulfonyl)ethanone; With (S)-2-{bis[3,5-bis(trifluoromethyl)phenyl][(trimethylsilanyl)oxy]methyl}pyrrolidine; 3-chlorobenzoate; In toluene; at -30 ℃;

With sodium tetrahydroborate; In methanol; toluene; at -30 ℃; for 3h; optical yield given as %ee; enantioselective reaction;

DOI:10.1021/ja903920j

Reference yield:

trans-2-pentenal (1576-87-0) + 1-(3-chlorophenyl)-2-(1-phenyl-1H-tetrazole-5-sulfonyl)ethanone (1174193-87-3) + orthoformic acid triethyl ester (122-51-0) → C17H23ClO2

Guidance literature:

trans-2-pentenal; 1-(3-chlorophenyl)-2-(1-phenyl-1H-tetrazole-5-sulfonyl)ethanone; With (S)-2-{bis[3,5-bis(trifluoromethyl)phenyl][(trimethylsilanyl)oxy]methyl}pyrrolidine; 3-chlorobenzoate; In toluene; at -30 ℃;

orthoformic acid triethyl ester; With toluene-4-sulfonic acid; In toluene; at 0 ℃; for 0.333333h;

With tetra-(n-butyl)ammonium iodide; sodium carbonate; In water; toluene; at 45 ℃; for 3h; optical yield given as %ee; enantioselective reaction;

DOI:10.1021/ja903920j

upstream raw materials:

C₁₅H₁₁ClN₄OS

Downstream raw materials:

(R,E)-5-(3-chlorophenyl)-3-ethylpent-4-yn-1-ol

Refernces