Phenylmethyl 2-fluoroacetate

Base Information

Chemical Name:Phenylmethyl 2-fluoroacetate
CAS No.:458-77-5
Molecular Formula:C₉H₉FO₂
Molecular Weight:168.168
Hs Code.:
DSSTox Substance ID:DTXSID201309790
Nikkaji Number:J416.746E

Synonyms:Phenylmethyl 2-fluoroacetate;SCHEMBL246474;DTXSID201309790;458-77-5

Suppliers and Price of Phenylmethyl 2-fluoroacetate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 2 raw suppliers

Chemical Property of Phenylmethyl 2-fluoroacetate

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:168.05865769
Heavy Atom Count:12
Complexity:142

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)COC(=O)CF

Technology Process of Phenylmethyl 2-fluoroacetate

There total 8 articles about Phenylmethyl 2-fluoroacetate 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: 95.0%

: 77902-89-7
benzyl <(trifluoromethyl)sulfonyloxy>acetate

: 458-77-5
benzyl 2-fluoroacetate

Guidance literature:: With potassium fluoride; 2,6-diisopropylphenyl; In 1,4-dioxane; at 45 ℃; for 1h; chemoselective reaction; Inert atmosphere; Glovebox;
DOI:10.1002/anie.201402238

Reference yield: 80.0%

: 5437-45-6
Benzyl bromoacetate

: 458-77-5
benzyl 2-fluoroacetate

Guidance literature:: With potassium fluoride; 2C₁₆H₃₆N⁽¹⁺⁾*C₂H₄O₆S₂^(2-); In water; tert-butyl alcohol; at 90 ℃; for 4h;
DOI:10.1021/acs.orglett.1c03887

Reference yield: 76.0%

: 140-11-4
Benzyl acetate

: 458-77-5
benzyl 2-fluoroacetate

Guidance literature:: With N-fluorobis<(trifluoromethyl)sulfonyl>imide; lithium diisopropyl amide; In tetrahydrofuran; at -80 ℃; other carbonyl compounds (esters, amides, ketones);
DOI:10.1021/jo00016a022