5-[4-(tert-Butyl)phenyl]-1H-1,2,4-triazole-3-thiol

Base Information

• Chemical Name: 5-[4-(tert-Butyl)phenyl]-1H-1,2,4-triazole-3-thiol
• CAS No.: 69480-15-5
• Molecular Formula: C12H15 N3 S
• Molecular Weight: 233.337
• Hs Code.: 2933998090
• Mol file: 69480-15-5.mol

Synonyms:5-[4-(TERT-BUTYL)PHENYL]-1H-1,2,4-TRIAZOLE-3-THIOL;3h-1,2,4-triazole-3-thione, 5-[4-(1,1-dimethylethyl)phenyl]-1,2-dihydro;5-(4-TERT-BUTYLPHENYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE;5-(4-(TERT-BUTYL)PHENYL)-1,2,4-TRIAZOLE-3-THIOL

Chemical Property of 5-[4-(tert-Butyl)phenyl]-1H-1,2,4-triazole-3-thiol

Chemical Property:

• Vapor Pressure: 0.00053mmHg at 25°C
• Boiling Point: 312.4°C at 760 mmHg
• Flash Point: 142.7°C
• PSA: 80.37000
• Density: 1.2g/cm³
• LogP: 3.05790

Purity/Quality:

99% ^*data from raw suppliers

5-[4-(tert-Butyl)phenyl]-1H-1,2,4-triazole-3-thiol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 5-[4-(tert-Butyl)phenyl]-1H-1,2,4-triazole-3-thiol

There total 12 articles about 5-[4-(tert-Butyl)phenyl]-1H-1,2,4-triazole-3-thiol 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: 95.0%

4-benzyl-3-(4-tert-butylphenyl)-5-(phenylsulfanyl)-4H-1,2,4-triazole (1001510-99-1) → 5-(4-tert-butylphenyl)-3-mercapto[1,2,4]triazole (69480-15-5)

Guidance literature:

With aluminum (III) chloride; In toluene; at 60 ℃; for 4h;

DOI:10.1016/j.tetlet.2013.06.067

Reference yield: 90.0%

2-(4-t-butylbenzoyl)hydrazinecarbothioamide → C12H15N3S (69480-15-5)

Guidance literature:

With sodium hydroxide; In methanol; Reflux;

DOI:10.2174/157018012799129882

Reference yield: 52.0%

2-(4-t-butylbenzoyl)hydrazinecarbothioamide → 5-(4-tert-butylphenyl)-3-mercapto[1,2,4]triazole (69480-15-5)

Guidance literature:

With sodium hydroxide; In water; for 3h; Heating;

upstream raw materials:

4-tert-butylbenzoic acid hydrazide

ammonium thiocyanate

4-benzyl-3-(4-tert-butylphenyl)-5-(phenylsulfanyl)-4H-1,2,4-triazole

methyl 4-tert-butylbenzoate

Downstream raw materials:

6-(4-tert-butylphenyl)-1,1-dioxo-3-pyrrolidino-1λ⁶-[1,2,4]triazolo[2,3-b][1,4,2,6]dithiadiazine

6-(4-tert-butylphenyl)-1,1-dioxo-3-piperidino-1λ⁶-[1,2,4]triazolo[2,3-b][1,4,2,6]dithiadiazine

6-(4-tert-butylphenyl)-3-dimethylamino-1,1-dioxo-1λ⁶-[1,2,4]triazolo[2,3-b][1,4,2,6]dithiadiazine

diethyl (3-((5-(4-(tert-butyl)phenyl)-1H-1,2,4-triazol-3-yl)thio)propyl)phosphonate

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