3-OXO-3-PHENYL-PROPIONALDEHYDE

Base Information

• Chemical Name: 3-OXO-3-PHENYL-PROPIONALDEHYDE
• CAS No.: 15397-33-8
• Molecular Formula: C9H8 O2
• Molecular Weight: 148.161
• Hs Code.: 2914400090
• Mol file: 15397-33-8.mol

Synonyms:Acetaldehyde,benzoyl- (6CI,7CI,8CI); 3-Oxo-3-phenylpropanal; Benzoylacetaldehyde; b-Oxobenzenepropanal

Chemical Property of 3-OXO-3-PHENYL-PROPIONALDEHYDE

Chemical Property:

• Melting Point: 77-78 °C
• Boiling Point: 259.4±23.0 °C(Predicted)
• PKA: 5.15±0.23(Predicted)
• PSA: 34.14000
• Density: 1.099±0.06 g/cm3(Predicted)
• LogP: 1.45830

Purity/Quality:

98%,99%, ^*data from raw suppliers

N-(2-Chloro-4-pyrimidinyl)-N-(2-phenylethyl)amine AldrichCPR ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-OXO-3-PHENYL-PROPIONALDEHYDE

There total 14 articles about 3-OXO-3-PHENYL-PROPIONALDEHYDE 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: 90.0%

3,3-trimethylenedithio-1-phenyl-1-propanone (78018-47-0) → 3-Oxo-3-phenylpropanal (15397-33-8)

Guidance literature:

With tetrafluoroboric acid; mercury(II) oxide; In tetrahydrofuran; water; for 2h; Ambient temperature;

DOI:10.1021/jo00052a064

Reference yield: 80.0%

2,3-epoxy-3-phenylpropanal (71403-94-6) → 3-Oxo-3-phenylpropanal (15397-33-8)

Guidance literature:

With 1-(carboxymethyl)-3-methylimidazolium chloride; at 60 - 65 ℃; for 1.6h;

DOI:10.1021/jo0500885

Reference yield:

3-benzenesulfonyl-3-hydroxy-1-phenyl-propan-1-one (856070-27-4) → Benzenesulfinic acid (618-41-7) + 3-Oxo-3-phenylpropanal (15397-33-8)

Guidance literature:

DOI:10.1002/1522-2640(200010)72:10<1216::AID-CITE1216>3.0.CO;2-W

upstream raw materials:

diphenylformamide

acetophenone

formic acid ethyl ester

3,3-trimethylenedithio-1-phenyl-1-propanone

Downstream raw materials:

1-phenyl-3-(p-tolylamino)prop-2-en-1-one

ethyl 2-methyl-6-phenylnicotinate

Benzoylacetaldehyde ω-semicarbazone

3-oxo-3-phenyl-propionaldehyde-(N-phenyl oxime )

Refernces

• 1、 Zhang, Jiantao,Xu, Jiaxi. "Chemoselectivity in the reaction of 2-diazo-3-oxo-3-phenylpropanal with aldehydes and ketones". . p. 1733 - 1739. Retrieved 2013/10/21.
• 2、 Liu, Jinbing,Cao, Rihui,Wu, Qifeng,Ma, Chunming,Wang, Zihou,Peng, Wenlie,Song, Huacan. "Synthesis and antibacterial evaluation of novel 4-alkyl substituted phenyl β-aldehyde ketone derivatives". experimental part. p. 1737 - 1744. Retrieved 2009/05/30.