4,4,4-Trifluorobutanal

Base Information

Chemical Name:4,4,4-Trifluorobutanal
CAS No.:406-87-1
Molecular Formula:C4H5F3O
Molecular Weight:126.078
Hs Code.:29121900
European Community (EC) Number:691-630-0
DSSTox Substance ID:DTXSID10380365
Nikkaji Number:J1.143.380D
Wikidata:Q82170561
Mol file:406-87-1.mol

Synonyms:4,4,4-trifluorobutanal;406-87-1;4,4,4-trifluorobutyraldehyde;4,4,4-trifluoro-butyraldehyde;MFCD00190643;Butanal, 4,4,4-trifluoro-;4,4,4-Trifluorobutaldehyde;4,4,4-trifluoro-1-butanal;SCHEMBL285606;4,4,4-tris(fluoranyl)butanal;DTXSID10380365;AKOS005259372;GS-3492;AM20100084;FT-0616972;EN300-175987;F20565;A825235;Q-103485

Suppliers and Price of 4,4,4-Trifluorobutanal

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

Chemenu
4,4,4-trifluorobutanal 95%+
10g
$ 550.00

Chemenu
4,4,4-trifluorobutanal 95%+
5g
$ 286.00

Chemenu
4,4,4-trifluorobutanal 95%+
1g
$ 200.00

American Custom Chemicals Corporation
4,4,4-TRIFLUOROBUTYRALDEHYDE 95.00%
5G
$ 1459.50

American Custom Chemicals Corporation
4,4,4-TRIFLUOROBUTYRALDEHYDE 95.00%
10G
$ 1446.98

American Custom Chemicals Corporation
4,4,4-TRIFLUOROBUTYRALDEHYDE 95.00%
1G
$ 635.71

Total 61 raw suppliers

Chemical Property of 4,4,4-Trifluorobutanal

Chemical Property:

Vapor Pressure:2.25mmHg at 25°C
Refractive Index:1.3387 (589.3 nm 25℃)
Boiling Point:60.3 °C at 760 mmHg
Flash Point:-3.606 °C
PSA：17.07000
Density:1.164 g/cm³
LogP:1.52780
XLogP3:1.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:126.02924926
Heavy Atom Count:8
Complexity:75.8

Purity/Quality:

99%, ^*data from raw suppliers

4,4,4-trifluorobutanal 95%+ ^*data from reagent suppliers

Safty Information:

Pictogram(s): F, Xi
Hazard Codes:F,Xi,Xn
Statements: 36/37/38-51-36-22
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 4,4,4-Trifluorobutanal

There total 14 articles about 4,4,4-Trifluorobutanal 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: 92.0%

: 677-21-4
1,1,1-trifluoropropylene

: 201230-82-2
carbon monoxide

: 406-87-1
4,4,4-trifluorobutanal

Guidance literature:: carbon monoxide; With hydroxo(1,5-cyclooctadiene)rhodium (I) dimer; hydrogen; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In N,N-dimethyl-formamide; at 100 ℃; for 1h; under 380.026 Torr;

1,1,1-trifluoropropylene; In N,N-dimethyl-formamide; at 100 ℃; for 18h; under 190.013 - 570.038 Torr;

Reference yield: 89.0%

: 677-21-4
1,1,1-trifluoropropylene

: 201230-82-2
carbon monoxide

: 406-87-1
4,4,4-trifluorobutanal

: 58928-28-2
3,3,3-trifluoro-2-methylpropionaldehyde

Guidance literature:: With hydrogen; carbonylhydridetris(triphenylphosphine)rhodium(I); In toluene; at 80 ℃; for 15h; in an autoclave;
DOI:10.1021/ja00259a020