3-Bromo-2-fluoropropan-1-OL

Base Information

• Chemical Name: 3-Bromo-2-fluoropropan-1-OL
• CAS No.: 4161-56-2
• Molecular Formula: C3H6BrFO
• Molecular Weight: 156.982
• European Community (EC) Number: 965-103-3
• Nikkaji Number: J1.298.179A
• Mol file: 4161-56-2.mol

Synonyms:3-BROMO-2-FLUOROPROPAN-1-OL;4161-56-2;SCHEMBL39134;MFCD20622230;EN300-1600517

Chemical Property of 3-Bromo-2-fluoropropan-1-OL

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 155.95861
• Heavy Atom Count: 6
• Complexity: 34

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(C(CBr)F)O

Technology Process of 3-Bromo-2-fluoropropan-1-OL

There total 1 articles about 3-Bromo-2-fluoropropan-1-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:

2-bromo-3-fluoropropan-1-ol (68064-54-0) → epifluorohydrine (503-09-3) + fluoro-2 bromo-3 propanol-1 (4161-56-2)

Guidance literature:

With sodium hydroxide; Yields of byproduct given; 0 deg C, 15 min; R_.T_., 24h;

DOI:10.1016/S0040-4039(00)99192-5

Reference yield: 78.0%

benzoyl cyanide (613-90-1) + fluoro-2 bromo-3 propanol-1 (4161-56-2) → 3-benzoyloxy-1-bromo-2-fluoropropane (144867-33-4)

Guidance literature:

With triethylamine; In dichloromethane; for 0.25h;

DOI:10.1135/cccc19921466

Reference yield:

fluoro-2 bromo-3 propanol-1 (4161-56-2) + 3-hydroxy-5-methylphenyl 2-(methylsulfonyl)benzenesulfonate (197960-66-0) → 2-methanesulfonyl-benzenesulfonic acid 3-(2-fluoro-3-hydroxy-propoxy)-5-methyl-phenyl ester

Guidance literature:

With caesium carbonate; In acetonitrile;

DOI:10.1016/S0960-894X(03)00125-2

upstream raw materials:

2-bromo-3-fluoropropan-1-ol

Downstream raw materials:

3-benzoyloxy-1-bromo-2-fluoropropane

fluoro-3 oxetane

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