2-Fluorophenethyl alcohol

Base Information

• Chemical Name: 2-Fluorophenethyl alcohol
• CAS No.: 50919-06-7
• Molecular Formula: C8H9FO
• Molecular Weight: 140.157
• Hs Code.: 29062990
• European Community (EC) Number: 670-569-3
• DSSTox Substance ID: DTXSID50369831
• Nikkaji Number: J267.328B
• Wikidata: Q72475817
• Mol file: 50919-06-7.mol

Synonyms:2-Fluorophenethyl alcohol;2-(2-fluorophenyl)ethanol;50919-06-7;2-(2-fluorophenyl)ethan-1-ol;Benzeneethanol, 2-fluoro-;2-fluorophenethylalcohol;MFCD00002887;o-Fluorophenethyl alcohol;2-(2-fluoro-phenyl)-ethanol;2-Fluorobenzeneethanol;2-(2-fluorophenyl)-ethanol;SCHEMBL625220;2-Fluorophenethyl alcohol, 99%;2-(2-Fluorophenyl)ethyl Alcohol;DTXSID50369831;BBL101061;STL554855;AKOS005256375;CS-W016461;SY021828;TS-01829;F0778;FT-0612443;EN300-72839;A24130;J-505627;Z397587382

Chemical Property of 2-Fluorophenethyl alcohol

Chemical Property:

• Appearance/Colour: Clear colorless liquid
• Vapor Pressure: 0.133mmHg at 25°C
• Refractive Index: n20/D 1.509(lit.)
• Boiling Point: 207.8 °C at 760 mmHg
• PKA: 14.68±0.10(Predicted)
• Flash Point: 98.3 °C
• PSA: 20.23000
• Density: 1.13 g/cm³
• LogP: 1.36050
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 140.063743068
• Heavy Atom Count: 10
• Complexity: 95.3

Purity/Quality:

97% ^*data from raw suppliers

2-(2-Fluorophenyl)ethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,Xi,C
• Hazard Codes: Xn,Xi,C
• Statements: 36/37/38-21/22-34
• Safety Statements: 36/37/39-26-45-27-37-23

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)CCO)F
• Uses: 2-(2-Fluorophenyl)ethanol is a useful synthetic intermediate. It is used to prepare phenethyl ester derivative analogs of the C-terminal tetrapeptide of gastrin as potent gastrin antagonists.

Technology Process of 2-Fluorophenethyl alcohol

There total 8 articles about 2-Fluorophenethyl alcohol 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%

(2-fluorophenyl)acetylene (766-49-4) → 2-(2-fluorophenyl)ethanol (50919-06-7)

Guidance literature:

With [2,2]bipyridinyl; formic acid; (η⁵-cyclopentadienyl) (η⁶-naphthalene)ruthenium hexafluorophosphate; water; In tetrahydrofuran; at 55 ℃; for 48h; Reagent/catalyst; Temperature; Time;

DOI:10.1038/nchem.1799

Reference yield: 97.0%

(2-fluorophenyl)acetic acid (451-82-1) → 2-(2-fluorophenyl)ethanol (50919-06-7)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 20 ℃; for 1h;

DOI:10.1002/adsc.200390009

Reference yield: 97.0%

sodium sulfate 10-hydrate + (2-fluorophenyl)acetic acid (451-82-1) → 2-(2-fluorophenyl)ethanol (50919-06-7)

Guidance literature:

In tetrahydrofuran;

upstream raw materials:

o-fluorophenylacetic acid ethyl ester

(2-fluorophenyl)acetic acid

2-fluorostyrene

methyl o-fluorophenylacetate

Downstream raw materials:

o-Fluor-β-phenethylhydrazin

2-(2-fluorophenyl)acetaldehyde

cyclohexylethan-1-ol

2-((1S,2R)-2-Fluoro-cyclohexyl)-ethanol