3-(trifluoromethyl)pentanedioic Acid

Base Information

Chemical Name:3-(trifluoromethyl)pentanedioic Acid
CAS No.:4162-55-4
Molecular Formula:C₆H₇F₃O₄
Molecular Weight:200.114
Hs Code.:
DSSTox Substance ID:DTXSID40460149
Wikidata:Q82284083
Mol file:4162-55-4.mol

Synonyms:3-(trifluoromethyl)pentanedioic Acid;4162-55-4;3-(trifluoromethyl)glutaric acid;3-TRIFLUOROMETHYL-PENTANEDIOIC ACID;SCHEMBL8877183;DTXSID40460149;3-(trifluoromethyl)pentanedioicAcid;AKOS015964120;EN300-206704;Z1269134920;7-trifluoromethyl-2,3,4,5-tetrahydro-1h-benzo[b]azepinehydrochloride

Suppliers and Price of 3-(trifluoromethyl)pentanedioic Acid

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

Crysdot
3-(Trifluoromethyl)pentanedioicacid 95+%
1g
$ 842.00

American Custom Chemicals Corporation
3-TRIFLUOROMETHYL-PENTANEDIOIC ACID 95.00%
10MG
$ 2194.50

American Custom Chemicals Corporation
3-TRIFLUOROMETHYL-PENTANEDIOIC ACID 95.00%
1MG
$ 779.63

AK Scientific
3-(Trifluoromethyl)pentanedioicAcid
1g
$ 831.00

Total 9 raw suppliers

Chemical Property of 3-(trifluoromethyl)pentanedioic Acid

Chemical Property:

Melting Point:104 °C
Boiling Point:284.5±35.0 °C(Predicted)
PKA:3.66±0.10(Predicted)
Density:1.497±0.06 g/cm3(Predicted)
Storage Temp.:2-8°C
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:200.02964319
Heavy Atom Count:13
Complexity:194

Purity/Quality:

98%Min ^*data from raw suppliers

3-(Trifluoromethyl)pentanedioicacid 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C(C(CC(=O)O)C(F)(F)F)C(=O)O

Technology Process of 3-(trifluoromethyl)pentanedioic Acid

There total 5 articles about 3-(trifluoromethyl)pentanedioic Acid 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%

: 25597-16-4
ethyl 4,4,4-trifluorocrotonate

: 105-53-3
diethyl malonate

: 4162-55-4
3-(trifluoromethyl)pentanedioic acid

Guidance literature:: With hydrogenchloride; potassium hydroxide; tetrabutylammomium bromide; In tetrahydrofuran; water; acetic acid;

Reference yield: 39.0%

: 853644-35-6
α,α'-dicyano-β-trifluoromethylglutamide

: 4162-55-4
3-(trifluoromethyl)pentanedioic acid

Guidance literature:: With hydrogenchloride; at 130 ℃; for 8h;
DOI:10.1021/jm050033v

Reference yield:

: 138852-02-5
diethyl 3-(trifluoromethyl)pentanedioate

: 4162-55-4
3-(trifluoromethyl)pentanedioic acid

Guidance literature:: diethyl 3-(trifluoromethyl)pentanedioate; With water; sodium hydroxide; In tetrahydrofuran; at 20 ℃; for 12h; Inert atmosphere;

With hydrogenchloride; In water; pH=1; Inert atmosphere;
DOI:10.1021/ol902592t