5-[3-(1-phenyl-1 H-tetrazol-5-ylsulfonyl)propyl]octanethioate

Base Information

• Chemical Name: 5-[3-(1-phenyl-1 H-tetrazol-5-ylsulfonyl)propyl]octanethioate
• CAS No.: 1196806-30-0
• Molecular Formula: C₁₈H₂₆N₄O₃S₂
• Molecular Weight: 410.561
• Mol file: 1196806-30-0.mol

Synonyms:5-[3-(1-phenyl-1 H-tetrazol-5-ylsulfonyl)propyl]octanethioate

Chemical Property of 5-[3-(1-phenyl-1 H-tetrazol-5-ylsulfonyl)propyl]octanethioate

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 5-[3-(1-phenyl-1 H-tetrazol-5-ylsulfonyl)propyl]octanethioate

There total 4 articles about 5-[3-(1-phenyl-1 H-tetrazol-5-ylsulfonyl)propyl]octanethioate 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: 64.0%

octanethioic S-acid (7530-92-9) + 3-[(1-phenyl-1H-tetrazol-5-yl)sulfonyl]propan-1-ol (717143-85-6) → 5-[3-(1-phenyl-1 H-tetrazol-5-ylsulfonyl)propyl]octanethioate (1196806-30-0)

Guidance literature:

With di-isopropyl azodicarboxylate; triphenylphosphine; In tetrahydrofuran; at 0 ℃; for 0.166667h; Inert atmosphere;

DOI:10.1055/s-0029-1216931

Reference yield:

1-octanesulfinic acid (3944-71-6) + C10H11IN4O2S → 5-[3-(1-phenyl-1 H-tetrazol-5-ylsulfonyl)propyl]octanethioate (1196806-30-0)

Guidance literature:

With potassium carbonate; In acetone; at 0 - 20 ℃; for 2h;

DOI:10.1021/acs.jmedchem.5b01044

Reference yield:

1-Phenyl-1H-tetrazole-5-thiol (86-93-1) → 5-[3-(1-phenyl-1 H-tetrazol-5-ylsulfonyl)propyl]octanethioate (1196806-30-0)

Guidance literature:

Multi-step reaction with 4 steps

1: potassium carbonate / acetone / 3 h / 0 - 20 °C

2: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 24 h / -20 - 20 °C

3: potassium iodide / acetone / 72 h / 65 °C

4: potassium carbonate / acetone / 2 h / 0 - 20 °C

With potassium carbonate; 3-chloro-benzenecarboperoxoic acid; potassium iodide; In dichloromethane; acetone;

DOI:10.1021/acs.jmedchem.5b01044

upstream raw materials:

octanethioic S-acid

3-[(1-phenyl-1H-tetrazol-5-yl)sulfonyl]propan-1-ol

1-Phenyl-1H-tetrazole-5-thiol

1-octanesulfinic acid

Refernces

• 1、 Wang, Bo,Huang, Po-Hsien,Chen, Ching-Shih,Forsyth, Craig J.. "Total syntheses of the histone deacetylase inhibitors largazole and 2-epi-largazole: Application of N-Heterocyclic carbene mediated acylations in complex molecule synthesis". experimental part. p. 1140 - 1150. Retrieved 2011/05/05.