1-(2-Fluorophenyl)propan-2-ol

Base Information

• Chemical Name: 1-(2-Fluorophenyl)propan-2-ol
• CAS No.: 549529-09-1
• Molecular Formula: C₉H₁₁FO
• Molecular Weight: 154.184
• DSSTox Substance ID: DTXSID80476966
• Nikkaji Number: J3.372.768B
• Mol file: 549529-09-1.mol

Synonyms:1-(2-fluorophenyl)propan-2-ol;549529-09-1;590417-83-7;1-(2-Fluorophenyl)-2-propanol;SCHEMBL2425148;DTXSID80476966;ADCVMZFALAHVRG-UHFFFAOYSA-N;(+)-1-(2-fluorophenyl)propan-2-ol;AKOS010014006;(+)-1-(2-fluorophenyl)-propan-2-ol;EN300-1252535

Chemical Property of 1-(2-Fluorophenyl)propan-2-ol

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 154.079393132
• Heavy Atom Count: 11
• Complexity: 116

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC1=CC=CC=C1F)O

Technology Process of 1-(2-Fluorophenyl)propan-2-ol

There total 6 articles about 1-(2-Fluorophenyl)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: 97.0%

sodium sulfate 10-hydrate + 2-(2-fluorophenyl)-1-methylethyl diisopropylcarbamate (549503-58-4) → 1-(2-fluorophenyl)propan-2-ol (549529-09-1,590417-83-7)

Guidance literature:

With diisobutylaluminium hydride; In tetrahydrofuran;

Reference yield: 90.0%

(o-fluorophenyl)acetone (2836-82-0) → 1-(2-fluorophenyl)propan-2-ol (549529-09-1,590417-83-7)

Guidance literature:

With tris(pentafluorophenyl)borate; hydrogen; In diethyl ether; at 70 ℃; for 12h; under 45603.1 Torr; Solvent; Glovebox;

DOI:10.1021/ja508829x

Reference yield: 82.0%

2-(2-fluorophenyl)-3-methyloxirane (234115-65-2) → 1-(2-fluorophenyl)propan-2-ol (549529-09-1,590417-83-7)

Guidance literature:

With cobalt(II) bis[bis((trifluoromethyl)sulfonyl)amide]; hydrogen; zinc trifluoromethanesulfonate; [2-((diphenylphospino)methyl)-2-methyl-1,3-propanediyl]bis[diphenylphosphine]; In tetrahydrofuran; at 80 ℃; for 16h; under 30003 Torr; regioselective reaction; Autoclave;

DOI:10.1002/anie.202002844

upstream raw materials:

2-(2-fluorophenyl)-1-methylethyl diisopropylcarbamate

(o-fluorophenyl)acetone

2-(2-fluorophenyl)-3-methyloxirane

1-allyl-2-fluorobenzene

Downstream raw materials:

1-(2-fluorophenyl)propan-2-yl acetate

1-fluoro-2-(2-methoxypropyl)benzene

(E)-ethyl 3-(3-fluoro-2-(2-methoxypropyl)phenyl)acrylate

(+)-2-(2-fluorophenyl)-1-methylethyl mesylate

Refernces

• 1、 Beller, Matthias,Junge, Kathrin,Leischner, Thomas,Li, Wu,Liu, Weiping. "A General Regioselective Synthesis of Alcohols by Cobalt-Catalyzed Hydrogenation of Epoxides". . p. 11321 - 11324. Retrieved 2020/05/16.
• 2、 Mahdi, Tayseer,Stephan, Douglas W.. "Enabling catalytic ketone hydrogenation by frustrated lewis pairs". supporting information. p. 15809 - 15812. Retrieved 2015/02/19.