1-Phenylheptane-1,4-dione

Base Information

Chemical Name:1-Phenylheptane-1,4-dione
CAS No.:63297-52-9
Molecular Formula:C13H16O2
Molecular Weight:204.26494
Hs Code.:2914399090
DSSTox Substance ID:DTXSID80493092
Wikidata:Q82339535

Synonyms:1-Phenylheptane-1,4-dione;63297-52-9;1-PHENYL-HEPTANE-1,4-DIONE;SCHEMBL8618388;DTXSID80493092;AKOS015965926

Suppliers and Price of 1-Phenylheptane-1,4-dione

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
1-Phenylheptane-1,4-dione 95+%
1g
$ 339.00

American Custom Chemicals Corporation
1-PHENYL-HEPTANE-1,4-DIONE 95.00%
5MG
$ 495.35

Alichem
1-Phenylheptane-1,4-dione
1g
$ 400.00

Total 4 raw suppliers

Chemical Property of 1-Phenylheptane-1,4-dione

Chemical Property:

PSA：34.14000
LogP:3.01870
Storage Temp.:2-8°C
XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:204.115029749
Heavy Atom Count:15
Complexity:215

Purity/Quality:

99% ^*data from raw suppliers

1-Phenylheptane-1,4-dione 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(=O)CCC(=O)C1=CC=CC=C1

Technology Process of 1-Phenylheptane-1,4-dione

There total 2 articles about 1-Phenylheptane-1,4-dione 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: 80.0%

: 583-06-2
3-benzoylacrylic acid

: 123-72-8
butyraldehyde

: 63297-52-9
1-phenylheptane-1,4-dione

Guidance literature:: With sodium carbonate; triethylamine; 3-benzyl-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium chloride; In ethanol; at 80 ℃; for 6h;

Reference yield: 51.0%

: 75-11-6
diiodomethane

: 5331-13-5
1-phenyl-1,3-hexanedione

: 63297-52-9
1-phenylheptane-1,4-dione

Guidance literature:: diiodomethane; With diethylzinc; trifluoroacetic acid; In dichloromethane; at 0 ℃; for 0.5h;

1-phenyl-1,3-hexanedione; In dichloromethane; at 20 ℃; for 5h;
DOI:10.1021/jo051950b