2-Fluorophenyl acetate

Base Information

• Chemical Name: 2-Fluorophenyl acetate
• CAS No.: 29650-44-0
• Molecular Formula: C8H7 F O2
• Molecular Weight: 154.141
• Hs Code.: 2915390090
• European Community (EC) Number: 608-389-4
• DSSTox Substance ID: DTXSID00183827
• Nikkaji Number: J834.307A
• Wikidata: Q83054668
• Mol file: 29650-44-0.mol

Synonyms:2-Fluorophenyl acetate;29650-44-0;1-Acetoxy-2-fluorobenzene;(2-fluorophenyl) acetate;Phenol, 2-fluoro-, acetate;MFCD00672912;2-fluorophenylacetate;Phenol,2-fluoro-,acetate;(2-fluorophenyl) ethanoate;SCHEMBL247351;Acetic acid 2-fluorophenyl ester;DTXSID00183827;3-Bromomethylbenzenesulfonylchloride;acetic acid (2-fluorophenyl) ester;AKOS005255082;PS-8877;SY224313;CS-0313232;FT-0738634;F13223;A819989

Chemical Property of 2-Fluorophenyl acetate

Chemical Property:

• Vapor Pressure: 0.45mmHg at 25°C
• Refractive Index: 1.478
• Boiling Point: 194.1°Cat760mmHg
• Flash Point: 69.5°C
• PSA: 26.30000
• Density: 1.174g/cm³
• LogP: 1.75100
• Storage Temp.: 2-8°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 154.04300762
• Heavy Atom Count: 11
• Complexity: 147

Purity/Quality:

98%Min ^*data from raw suppliers

1-Acetoxy-2-fluorobenzene 98% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T
• Statements: 20/21/22-36
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1=CC=CC=C1F

Technology Process of 2-Fluorophenyl acetate

There total 10 articles about 2-Fluorophenyl acetate 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: 100.0%

2-fluorophenol (367-12-4) + acetyl chloride (75-36-5) → 2-fluorophenyl acetate (29650-44-0)

Guidance literature:

With pyridine; In dichloromethane; at 20 ℃; for 2h;

DOI:10.1021/jm500802j

Reference yield: 99.0%

2-fluorophenol (367-12-4) + acetic anhydride (108-24-7) → 2-fluorophenyl acetate (29650-44-0)

Guidance literature:

With silver trifluoromethanesulfonate; at 60 ℃; for 0.0166667h; neat (no solvent);

DOI:10.1055/s-0030-1259999

Reference yield:

2-fluorophenol (367-12-4) + 4-nitrophenol acetate (830-03-5) → 4-nitro-phenol (100-02-7,78813-13-5,89830-32-0) + 2-fluorophenyl acetate (29650-44-0)

Guidance literature:

With Tris buffer; In water; at 25 ℃; Rate constant;

DOI:10.1039/P29960002285

upstream raw materials:

2-fluorophenol

vinyl acetate

3-nitrophenyl acetate

2-fluorophenolate anion

Downstream raw materials:

1-(3-fluoro-2-hydroxyphenyl)-ethanone

2-Fluoro-4-(5-fluoro-1H-indol-2-yl)-phenol

2-Fluoro-4-{1-[(4-fluoro-phenyl)-hydrazono]-ethyl}-phenol

tert-butyl 4-(4-((7-fluoro-2',3',5',6'-tetrahydrospiro[chromeno[3,4-d]pyrimidine-5,4'-pyrane]-3-yl)amino)phenyl)-piperazine-1-carboxylate

Refernces

• 1、 Cao, Wenwen,Li, Xiaoxin,Wu, Peng,Xiong, Hu. "Development of pH-activatable fluorescent probes for rapid visualization of metastatic tumours and fluorescence-guided surgeryviatopical spraying". supporting information. p. 10636 - 10639. Retrieved 2021/10/19.
• 2、 Seth, Saona,Venugopalan, Paloth,Moorthy, Jarugu Narasimha. "Porous coordination polymers of diverse topologies based on a twisted tetrapyridylbiaryl: Application as nucleophilic catalysts for acetylation of phenols". . p. 2241 - 2249. Retrieved 2015/01/30.