4-(4-Hexylphenyl)-4-oxobutanoic acid

Base Information

Chemical Name:4-(4-Hexylphenyl)-4-oxobutanoic acid
CAS No.:64779-08-4
Molecular Formula:C16H22O3
Molecular Weight:262.349
Hs Code.:2918300090
DSSTox Substance ID:DTXSID00384256
Mol file:64779-08-4.mol

Synonyms:64779-08-4;4-(4-hexylphenyl)-4-oxobutanoic acid;4-(4-Hexylphenyl)-4-oxobutyric acid;MFCD00173762;SCHEMBL3130654;DTXSID00384256;4-(4-hexylphenyl)-4-oxobutanoicacid;AKOS016022765;CCG-236323

Suppliers and Price of 4-(4-Hexylphenyl)-4-oxobutanoic 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

Rieke Metals
4-(4-Hexylphenyl)-4-oxobutyricacid 97%
1g
$ 366.00

Rieke Metals
4-(4-Hexylphenyl)-4-oxobutyricacid 97%
5g
$ 1514.00

Rieke Metals
4-(4-Hexylphenyl)-4-oxobutyricacid 97%
2g
$ 618.00

Matrix Scientific
4-(4-Hexylphenyl)-4-oxobutyric acid
2g
$ 614.00

Matrix Scientific
4-(4-Hexylphenyl)-4-oxobutyric acid
1g
$ 385.00

Matrix Scientific
4-(4-Hexylphenyl)-4-oxobutyric acid
5g
$ 1412.00

Crysdot
4-(4-Hexylphenyl)-4-oxobutanoicacid 97%
5g
$ 1131.00

American Custom Chemicals Corporation
4-(4-HEXYLPHENYL)-4-OXOBUTYRIC ACID 95.00%
10G
$ 3395.70

American Custom Chemicals Corporation
4-(4-HEXYLPHENYL)-4-OXOBUTYRIC ACID 95.00%
5G
$ 2243.59

American Custom Chemicals Corporation
4-(4-HEXYLPHENYL)-4-OXOBUTYRIC ACID 95.00%
1G
$ 958.07

Total 1 raw suppliers

Chemical Property of 4-(4-Hexylphenyl)-4-oxobutanoic acid

Chemical Property:

Vapor Pressure:1.53E-08mmHg at 25°C
Refractive Index:1.519
Boiling Point:440.7°C at 760 mmHg
PKA:4.58±0.17(Predicted)
Flash Point:234.4°C
PSA：54.37000
Density:1.06g/cm³
LogP:3.85690
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:262.15689456
Heavy Atom Count:19
Complexity:278

Purity/Quality:: 4-(4-Hexylphenyl)-4-oxobutyricacid 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCC1=CC=C(C=C1)C(=O)CCC(=O)O

Technology Process of 4-(4-Hexylphenyl)-4-oxobutanoic acid

There total 2 articles about 4-(4-Hexylphenyl)-4-oxobutanoic 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:

: 108-30-5
succinic acid anhydride

: 1077-16-3
hexylbenzene

: 64779-08-4
4-(4-hexyl-phenyl)-4-oxo-butyric acid

Guidance literature:: With carbon disulfide; aluminium trichloride;
DOI:10.1021/ja01172a020

Reference yield:

: 108-30-5
succinic acid anhydride

: 7446-70-0
aluminium trichloride

: 630-20-6
1,1,1,2-tetrachoroethane

: 1077-16-3
hexylbenzene

: 64779-08-4
4-(4-hexyl-phenyl)-4-oxo-butyric acid

Guidance literature:: at 0 ℃;

Reference yield:

: 40052-13-9
mono-tert-butyl malonate

: 64779-08-4
4-(4-hexyl-phenyl)-4-oxo-butyric acid

: C₂₂H₃₂O₄

Guidance literature:: 4-(4-hexyl-phenyl)-4-oxo-butyric acid; With 1,1'-carbonyldiimidazole; In tetrahydrofuran; at 20 ℃; for 1h;

mono-tert-butyl malonate; With isopropylmagnesium bromide; In tetrahydrofuran; at 0 - 20 ℃; for 4h;
DOI:10.1002/anie.201502233