2-(4-Bromo-1,3-thiazol-2-yl)propan-2-ol

Base Information

• Chemical Name: 2-(4-Bromo-1,3-thiazol-2-yl)propan-2-ol
• CAS No.: 761447-63-6
• Molecular Formula: C6H8BrNOS
• Molecular Weight: 222.106
• Hs Code.: 2934100090
• European Community (EC) Number: 672-881-5
• DSSTox Substance ID: DTXSID80376795
• Wikidata: Q82165715
• Mol file: 761447-63-6.mol

Synonyms:761447-63-6;2-(4-Bromothiazole)propan-2-ol;2-(4-Bromothiazol-2-yl)propan-2-ol;2-(4-bromo-1,3-thiazol-2-yl)propan-2-ol;4-Bromo-2-(2-hydroxyprop-2-yl)-1,3-thiazole;SCHEMBL2879612;DTXSID80376795;DIYKULIZPAXQQZ-UHFFFAOYSA-N;MFCD06660119;AKOS015841427;PS-3840;CS-0206228;FT-0685141;EN300-7069209;J-505931

Chemical Property of 2-(4-Bromo-1,3-thiazol-2-yl)propan-2-ol

Chemical Property:

• Vapor Pressure: 0.00294mmHg at 25°C
• Boiling Point: 272.6oC at 760 mmHg
• Flash Point: 118.7oC
• PSA: 61.36000
• Density: 1.632g/cm3
• LogP: 2.13300
• Storage Temp.: 2-8°C
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 220.95100
• Heavy Atom Count: 10
• Complexity: 131

Purity/Quality:

97% ^*data from raw suppliers

4-Bromo-2-(2-hydroxyprop-2-yl)-1,3-thiazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C1=NC(=CS1)Br)O

Technology Process of 2-(4-Bromo-1,3-thiazol-2-yl)propan-2-ol

There total 2 articles about 2-(4-Bromo-1,3-thiazol-2-yl)propan-2-ol 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: 84.0%

→ 2-(4-bromo-1,3-thiazol-2-yl)propan-2-ol (761447-63-6)

Guidance literature:

Reference yield: 64.0%

2,4-dibromo-1,3-thiazole (4175-77-3) + acetone (67-64-1) → 2-(4-bromo-1,3-thiazol-2-yl)propan-2-ol (761447-63-6)

Guidance literature:

2,4-dibromo-1,3-thiazole; With tert.-butyl lithium; In diethyl ether; hexane; at -78 ℃; for 0.5h;

acetone; In diethyl ether; hexane; at -78 ℃; for 1h;

DOI:10.1021/ol048893d

Reference yield:

5-[(4-acetyl-2,6-dichlorophenyl)amino]-9-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[c]-2,6-naphthyridin-1(2H)-one (1131736-46-3) + 2-(4-bromo-1,3-thiazol-2-yl)propan-2-ol (761447-63-6) → 5-[(4-acetyl-2,6-dichlorophenyl)amino]-9-[2-(1-hydroxy-1-methylethyl)-1,3-thiazol-4-yl]benzo[c]-2,6-naphthyridin-1(2H)-one (1131736-48-5)

Guidance literature:

With sodium carbonate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In tetrahydrofuran; water; at 80 ℃; for 16h;

upstream raw materials:

2,4-dibromo-1,3-thiazole

acetone

Downstream raw materials:

5-[(4-acetyl-2,6-dichlorophenyl)amino]-9-[2-(1-hydroxy-1-methylethyl)-1,3-thiazol-4-yl]benzo[c]-2,6-naphthyridin-1(2H)-one

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