3-(2-Furyl)-2-(trifluoromethyl)propanoic acid

Base Information

Chemical Name:3-(2-Furyl)-2-(trifluoromethyl)propanoic acid
CAS No.:241154-04-1
Molecular Formula:C₈H₇F₃O₃
Molecular Weight:208.137
Hs Code.:2932190090
DSSTox Substance ID:DTXSID20379245
Mol file:241154-04-1.mol

Synonyms:241154-04-1;3,3,3-trifluoro-2-(furan-2-ylmethyl)propanoic acid;3-(2-Furyl)-2-(trifluoromethyl)propanoic acid;3-(Fur-2-yl)-2-(trifluoromethyl)propanoic acid;DTXSID20379245;MFCD01320771;AKOS015855833;FS-1079;BB 0259361;3-fur-2-yl-2-(trifluoromethyl)Propanoic acid;3-fur-2-yl-2-(trifluoromethyl)propionic acid;3,3,3-trifluoro-2-(furan-2-ylmethyl)propanoicacid

Suppliers and Price of 3-(2-Furyl)-2-(trifluoromethyl)propanoic 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
3,3,3-Trifluoro-2-(furan-2-ylmethyl)propanoicacid 97%
10g
$ 371.00

American Custom Chemicals Corporation
3-FUR-2-YL-2-(TRIFLUOROMETHYL)PROPIONIC ACID 95.00%
5G
$ 1210.63

American Custom Chemicals Corporation
3-FUR-2-YL-2-(TRIFLUOROMETHYL)PROPIONIC ACID 95.00%
1G
$ 679.37

American Custom Chemicals Corporation
3-FUR-2-YL-2-(TRIFLUOROMETHYL)PROPIONIC ACID 95.00%
250MG
$ 613.88

Total 1 raw suppliers

Chemical Property of 3-(2-Furyl)-2-(trifluoromethyl)propanoic acid

Chemical Property:

Boiling Point:238.7±40.0 °C(Predicted)
PKA:2.96±0.11(Predicted)
PSA：50.44000
Density:1.392±0.06 g/cm3(Predicted)
LogP:2.08520
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:208.03472857
Heavy Atom Count:14
Complexity:214

Purity/Quality:: 3,3,3-Trifluoro-2-(furan-2-ylmethyl)propanoicacid 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 3-(2-Furyl)-2-(trifluoromethyl)propanoic acid

There total 4 articles about 3-(2-Furyl)-2-(trifluoromethyl)propanoic 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:

: (Z)-3-(furan-2-yl)-2-(trifluoromethyl)acrylic acid

: 241154-04-1
(R)-3,3,3-trifluoro-2-(furan-2-ylmethyl)propanoic acid

Guidance literature:: With morpholine; bis(1,5-cyclooctadiene)rhodium(I) hexafluorophosphate; C₂₄H₂₁O₃P; triphenylphosphine; In chloroform; water; at 20 ℃; for 16h; under 15201 Torr; enantioselective reaction; Inert atmosphere; Schlenk technique;
DOI:10.1002/anie.201307903

Reference yield:

: (Z)-3-(thiophen-2-yl)-2-(trifluoromethyl)acrylic acid

: 241154-04-1
(R)-3,3,3-trifluoro-2-(furan-2-ylmethyl)propanoic acid

Guidance literature:: With morpholine; bis(1,5-cyclooctadiene)rhodium(I) hexafluorophosphate; C₂₄H₂₁O₃P; triphenylphosphine; In chloroform; water; at 20 ℃; for 16h; under 15201 Torr; enantioselective reaction; Inert atmosphere; Schlenk technique;
DOI:10.1002/anie.201307903

Reference yield:

: 98-01-1
furfural

: 241154-04-1
(R)-3,3,3-trifluoro-2-(furan-2-ylmethyl)propanoic acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: titanium tetrachloride / tetrahydrofuran; dichloromethane / 0.5 h / 20 °C

1.2: 40 h

2.1: bis(1,5-cyclooctadiene)rhodium(I) hexafluorophosphate; C₂₄H₂₁O₃P; triphenylphosphine; morpholine / chloroform; water / 16 h / 20 °C / 15201 Torr / Inert atmosphere; Schlenk technique

With morpholine; bis(1,5-cyclooctadiene)rhodium(I) hexafluorophosphate; C₂₄H₂₁O₃P; titanium tetrachloride; triphenylphosphine; In tetrahydrofuran; dichloromethane; chloroform; water;
DOI:10.1002/anie.201307903