1-(2-Methoxyphenyl)propane-1,2-dione

Base Information

Chemical Name:1-(2-Methoxyphenyl)propane-1,2-dione
CAS No.:39951-14-9
Molecular Formula:C10H10O3
Molecular Weight:178.18500
Hs Code.:
DSSTox Substance ID:DTXSID40559820
Wikidata:Q82442669
Mol file:39951-14-9.mol

Synonyms:1-(2-Methoxyphenyl)propane-1,2-dione;39951-14-9;1,2-Propanedione, 1-(2-methoxyphenyl)-;DTXSID40559820

Suppliers and Price of 1-(2-Methoxyphenyl)propane-1,2-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

Total 3 raw suppliers

Chemical Property of 1-(2-Methoxyphenyl)propane-1,2-dione

Chemical Property:

PSA：43.37000
LogP:1.46690
XLogP3:1.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:178.062994177
Heavy Atom Count:13
Complexity:210

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)C(=O)C1=CC=CC=C1OC

Technology Process of 1-(2-Methoxyphenyl)propane-1,2-dione

There total 3 articles about 1-(2-Methoxyphenyl)propane-1,2-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: 72.0%

: 119072-55-8,7188-38-7
tert-butylisonitrile

: 578-57-4
2-bromoanisole

: 75-24-1
trimethylaluminum

: 39951-14-9
1-(2-methoxyphenyl)propane-1,2-dione

Guidance literature:: tert-butylisonitrile; 2-bromoanisole; trimethylaluminum; With 1,3-bis-(diphenylphosphino)propane; palladium dichloride; In toluene; at 20 ℃; for 0.0833333h; Sealed tube; Inert atmosphere;

With potassium tert-butylate; In toluene; at 20 - 100 ℃; for 16h; Sealed tube; Inert atmosphere;

With hydrogenchloride; water; In toluene; at 20 ℃; for 1h; Sealed tube; Inert atmosphere;
DOI:10.1021/acs.orglett.9b04414

Reference yield: 65.0%

: 5211-62-1
1-(2-methoxyphenyl)propan-2-one

: 39951-14-9
1-(2-methoxyphenyl)propane-1,2-dione

Guidance literature:: With pyridine; pyridinium chlorochromate; In dichloromethane; for 15h; Heating;

Reference yield:

: 5561-92-2
1-(2-methoxyphenyl)propan-1-one

: 39951-14-9
1-(2-methoxyphenyl)propane-1,2-dione

Guidance literature:: Multi-step reaction with 2 steps

1: nBuONO, HCl

2: aq. H₂SO₄

With hydrogenchloride; n-Butyl nitrite; sulfuric acid;
DOI:10.1246/bcsj.47.2255