1-(4-Fluorophenyl)-4-hydroxybutan-1-one

Base Information

Chemical Name:1-(4-Fluorophenyl)-4-hydroxybutan-1-one
CAS No.:73206-04-9
Molecular Formula:C₁₀H₁₁FO₂
Molecular Weight:182.195
Hs Code.:
European Community (EC) Number:862-740-8
UNII:AW6KZC7APD
Nikkaji Number:J2.705.677F

Synonyms:1-(4-fluorophenyl)-4-hydroxybutan-1-one;73206-04-9;1-(4-Fluorophenyl)-4-hydroxy-1-butanone;AW6KZC7APD;SCHEMBL11680631;MFCD08443119;AKOS000125998;MCULE-9526662105;CS-0159407;1-Butanone, 1-(4-fluorophenyl)-4-hydroxy-;EN300-35869;G45143;Z228585372

Suppliers and Price of 1-(4-Fluorophenyl)-4-hydroxybutan-1-one

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 7 raw suppliers

Chemical Property of 1-(4-Fluorophenyl)-4-hydroxybutan-1-one

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:182.07430775
Heavy Atom Count:13
Complexity:162

Purity/Quality:: 98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1C(=O)CCCO)F

Technology Process of 1-(4-Fluorophenyl)-4-hydroxybutan-1-one

There total 6 articles about 1-(4-Fluorophenyl)-4-hydroxybutan-1-one 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: 99.0%

: 456-22-4
4-Fluorobenzoic acid

: propan-1-ol-3-magnesium chloride

: 73206-04-9
1-(4-fluorophenyl)-4-hydroxybutan-1-one

Guidance literature:: 4-Fluorobenzoic acid; With tert-butylmagnesium chloride; In tetrahydrofuran; toluene; at 0 ℃; for 0.25h; Inert atmosphere;

propan-1-ol-3-magnesium chloride; With diisopropylaminomagnesium chloride lithium chloride; In tetrahydrofuran; toluene; at 0 - 20 ℃; for 24.25h; Inert atmosphere; Sonication;
DOI:10.1021/acs.orglett.9b02899

Reference yield:

: 96-48-0
4-butanolide

: 460-00-4
1-Bromo-4-fluorobenzene

: 73206-04-9
1-(4-fluorophenyl)-4-hydroxybutan-1-one

Guidance literature:: 1-Bromo-4-fluorobenzene; With tert.-butyl lithium; In diethyl ether; pentane; at -78 ℃; for 1h;

4-butanolide; In diethyl ether; pentane; at -78 ℃; for 1h;
DOI:10.1002/anie.201409572

Reference yield:

: 462-06-6
fluorobenzene

: 73206-04-9
1-(4-fluorophenyl)-4-hydroxybutan-1-one

Guidance literature:: Multi-step reaction with 4 steps

1: aluminum (III) chloride / dichloromethane

2: sodium tetrahydroborate / methanol

3: potassium tert-butylate / tetrahydrofuran; ethanol / 4 h / 20 °C

4: 4-acetylamino-2,2,6,6-tetramethylpiperidine-1-oxoammonium tetrafluoroborate / acetonitrile; water; diethyl ether / 20 °C

With aluminum (III) chloride; sodium tetrahydroborate; potassium tert-butylate; 4-acetylamino-2,2,6,6-tetramethylpiperidine-1-oxoammonium tetrafluoroborate; In tetrahydrofuran; methanol; diethyl ether; ethanol; dichloromethane; water; acetonitrile;
DOI:10.1039/c6ob00347h