5-Phenylpent-1-yn-3-one

Base Information

Chemical Name:5-Phenylpent-1-yn-3-one
CAS No.:118584-91-1
Molecular Formula:C11H10O
Molecular Weight:158.2
Hs Code.:
DSSTox Substance ID:DTXSID101313938
Nikkaji Number:J806.009F

Synonyms:5-phenylpent-1-yn-3-one;118584-91-1;5-Phenyl-1-pentyn-3-one;SCHEMBL2570402;DTXSID101313938;MFCD21262984;AKOS014915468;AS-55108;CS-0309380;EN300-180283;W16385;A1-02301;Z1266856412

Suppliers and Price of 5-Phenylpent-1-yn-3-one

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

Total 2 raw suppliers

Chemical Property of 5-Phenylpent-1-yn-3-one

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:158.073164938
Heavy Atom Count:12
Complexity:190

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C#CC(=O)CCC1=CC=CC=C1

Technology Process of 5-Phenylpent-1-yn-3-one

There total 7 articles about 5-Phenylpent-1-yn-3-one 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: 89.0%

: 99902-35-9,130325-02-9,67648-04-8
5-phenylpent-1-yn-3-ol

: 118584-91-1
5-phenylpent-1-yn-3-one

Guidance literature:: With 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione; In tetrahydrofuran; dimethyl sulfoxide; at 30 ℃; for 5h; Inert atmosphere;
DOI:10.1039/c7ob02406a

Reference yield:

: 104-53-0
3-phenyl-propionaldehyde

: 118584-91-1
5-phenylpent-1-yn-3-one

Guidance literature:: Multi-step reaction with 2 steps

1: tetrahydrofuran; diethyl ether / 2.5 h / 0 - 21 °C / Inert atmosphere

2: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / tetrahydrofuran; dimethyl sulfoxide / 5 h / 30 °C / Inert atmosphere

With 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione; In tetrahydrofuran; diethyl ether; dimethyl sulfoxide;
DOI:10.1039/c7ob02406a

Reference yield:

: 140149-77-5
5-phenyl-1-trimethylsilylpent-1-yn-3-ol

: 118584-91-1
5-phenylpent-1-yn-3-one

Guidance literature:: Multi-step reaction with 2 steps

1: potassium carbonate / methanol / 2 h / 20 °C

2: manganese(IV) oxide / dichloromethane / 2 h / 20 °C

With manganese(IV) oxide; potassium carbonate; In methanol; dichloromethane;
DOI:10.1039/d0ob02158j