Fluvoxketone

Base Information

Chemical Name:Fluvoxketone
CAS No.:61718-80-7
Molecular Formula:C13H15F3O2
Molecular Weight:260.256
Hs Code.:2914500090
European Community (EC) Number:425-000-1,612-211-0
UNII:8D8A03845N
DSSTox Substance ID:DTXSID60210724
Nikkaji Number:J932.057A
Wikidata:Q27270215

Synonyms:61718-80-7;Fluvoxketone;5-METHOXY-1-[4-(TRIFLUOROMETHYL)PHENYL]-1-PENTANONE;5-methoxy-1-(4-(trifluoromethyl)phenyl)pentan-1-one;5-methoxy-1-[4-(trifluoromethyl)phenyl]pentan-1-one;(4-Methoxybutyl)(4-trifluoromethylphenyl)methanone;Fluvoxamine (ketone);5-Methoxy-4'-(trifluoromethyl)valerophenone;5-Methoxy-4-Trifluoromethyl Valerophenone;UNII-8D8A03845N;8D8A03845N;EC 425-000-1;MFCD06658173;1-Pentanone, 5-methoxy-1-[4-(trifluoromethyl)phenyl]-;5-methoxy-1-(4-(trifluoromethyl)phenyl)-1-pentanone;5-Methoxy-1-[4-(trifluoromethyl)-phenyl]pentan-1-one;1-PENTANONE, 5-METHOXY-1-(4-(TRIFLUOROMETHYL)PHENYL)-;C13H15F3O2;Fluvoxamine Impurity D;SCHEMBL2671567;DTXSID60210724;BCP10170;AKOS005064032;AC-1407;PS-7367;5-methoxy-4'-trifluoromethylvalerophenone;A8549;CS-0103012;FT-0640783;C75897;omega-Methoxy-4'-(trifluoromethyl)valerophenone;EN300-7375732;FLUVOXAMINE MALEATE IMPURITY D [EP IMPURITY];Q-101520;5-methoxy-1-[4-(trifluoromethyl)-phenyl]-1-pentanone;Q27270215;Z2065531078;5-METHOXY-4'-(TRIFLUOROMETHYL)VALEROPHENONE KETONE;FLUVOXAMINE MALEATE IMPURITY, 5-METHOXY-4'-(TRIFLUOROMETHYL)VALEROPHENONE KETONE- [USP IMPURITY]

Suppliers and Price of Fluvoxketone

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

TRC
Fluvoxketone
250mg
$ 175.00

TRC
Fluvoxketone
2g
$ 1125.00

SynQuest Laboratories
5-Methoxy-1-[4-(trifluoromethyl)phenyl]pentan-1-one
25 g
$ 480.00

SynQuest Laboratories
5-Methoxy-1-[4-(trifluoromethyl)phenyl]pentan-1-one
1 g
$ 72.00

SynQuest Laboratories
5-Methoxy-1-[4-(trifluoromethyl)phenyl]pentan-1-one
5 g
$ 224.00

Sigma-Aldrich
Fluvoxamine impurity D British Pharmacopoeia (BP) Reference Standard
bp1190
$ 203.00

Sigma-Aldrich
Fluvoxamine impurity D European Pharmacopoeia (EP) Reference Standard
y0000916
$ 190.00

Matrix Scientific
5-Methoxy-1-[4-(trifluoromethyl)-phenyl]-1-pentanone 95+%
25g
$ 675.00

Matrix Scientific
5-Methoxy-1-[4-(trifluoromethyl)-phenyl]-1-pentanone 95+%
5g
$ 350.00

Matrix Scientific
5-Methoxy-1-[4-(trifluoromethyl)-phenyl]-1-pentanone 95+%
1g
$ 125.00

Total 141 raw suppliers

Chemical Property of Fluvoxketone

Chemical Property:

Appearance/Colour:White Solid
Vapor Pressure:0.000356mmHg at 25°C
Melting Point:50-52 °C
Refractive Index:1.454
Boiling Point:318.7 °C at 760 mmHg
Flash Point:141.8 °C
PSA：26.30000
Density:1.147 g/cm³
LogP:3.70480
Storage Temp.:Refrigerator
Water Solubility.:74.36mg/L at 20℃
XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:260.10241420
Heavy Atom Count:18
Complexity:256

Purity/Quality:

98% ^*data from raw suppliers

Fluvoxketone ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COCCCCC(=O)C1=CC=C(C=C1)C(F)(F)F
Uses Fluvoxamine intermediate

Technology Process of Fluvoxketone

There total 6 articles about Fluvoxketone 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: 90.5%

: 17913-18-7
4-(methoxy)-1-chlorobutane

: 2967-66-0
methyl 4-(trifluoromethyl)benzoate

: 61718-80-7
5-methoxy-1-[4-(trifluoromethyl)phenyl]pentan-1-one

Guidance literature:: 4-(methoxy)-1-chlorobutane; With magnesium; methyl iodide; In tetrahydrofuran; at 75 ℃; for 13h; Inert atmosphere;

methyl 4-(trifluoromethyl)benzoate; In tetrahydrofuran; at 20 - 70 ℃; Inert atmosphere;

Reference yield: 71.84%

: 4457-67-4
4-Methoxy-1-bromobutane

: 455-18-5
4-CF₃C₆H₄CN

: 106-93-4
ethylene dibromide

: 61718-80-7
5-methoxy-1-[4-(trifluoromethyl)phenyl]pentan-1-one

Guidance literature:: With magnesium; In tetrahydrofuran;

Reference yield: 32.0%

: 4457-67-4
4-Methoxy-1-bromobutane

: 455-18-5
4-CF₃C₆H₄CN

: 61718-80-7
5-methoxy-1-[4-(trifluoromethyl)phenyl]pentan-1-one

Guidance literature:: 4-Methoxy-1-bromobutane; With magnesium; ethylene dibromide; In diethyl ether; Inert atmosphere;

4-CF₃C₆H₄CN; In diethyl ether; for 8h; Inert atmosphere; Reflux;
DOI:10.1016/j.ejmech.2021.113533