4-Penten-1-one, 2-hydroxy-2-methyl-1-phenyl-

Base Information

• Chemical Name: 4-Penten-1-one, 2-hydroxy-2-methyl-1-phenyl-
• CAS No.: 123507-41-5
• Molecular Formula: C12H14O2
• Molecular Weight: 190.242
• DSSTox Substance ID: DTXSID00473492
• Nikkaji Number: J1.708.119E
• Mol file: 123507-41-5.mol

Synonyms:4-Penten-1-one, 2-hydroxy-2-methyl-1-phenyl-;123507-41-5;SCHEMBL11086781;DTXSID00473492

Chemical Property of 4-Penten-1-one, 2-hydroxy-2-methyl-1-phenyl-

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 190.099379685
• Heavy Atom Count: 14
• Complexity: 216

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-Penten-1-one, 2-hydroxy-2-methyl-1-phenyl-

There total 11 articles about 4-Penten-1-one, 2-hydroxy-2-methyl-1-phenyl- 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: 88.0%

1-(Dimethyl-hydrazono)-2-methyl-1-phenyl-pent-4-en-2-ol (123507-38-0) → 2-Hydroxy-2-methyl-1-phenyl-pent-4-en-1-one (123507-41-5)

Guidance literature:

With copper dichloride; In tetrahydrofuran; water; Ambient temperature;

DOI:10.1021/jo00284a005

Reference yield: 77.0%

2-Diazo-3-oxo-butyric acid methyl ester (24762-04-7) + 1-diazo-1-phenyl-2-propanone (3893-35-4) → 2-Hydroxy-2-methyl-1-phenyl-pent-4-en-1-one (123507-41-5)

Guidance literature:

With dirhodium tetraacetate; In benzene; for 0.166667h; Heating;

DOI:10.1021/ja983294l

Reference yield: 66.0%

allyl bromide (106-95-6) + 1-Phenylpropane-1,2-dione (579-07-7) → 2-Hydroxy-2-methyl-1-phenyl-pent-4-en-1-one (123507-41-5) + 3-hydroxy-3-phenylhex-5-en-2-one (87258-91-1)

Guidance literature:

With indium; ammonium chloride; In methanol; for 6h; Heating;

DOI:10.1081/SCC-120001511

upstream raw materials:

2-(allyloxy)-1-phenylpropan-1-one

1-(Dimethyl-hydrazono)-2-methyl-1-phenyl-pent-4-en-2-ol

trimethyl(allyl)stannane

1-Phenylpropane-1,2-dione