1-(2-Hydroxyphenyl)-2-phenylethanone

Base Information

• Chemical Name: 1-(2-Hydroxyphenyl)-2-phenylethanone
• CAS No.: 2491-31-8
• Molecular Formula: C14H12 O2
• Molecular Weight: 212.248
• Hs Code.: 2914501900
• European Community (EC) Number: 811-798-2
• DSSTox Substance ID: DTXSID70179616
• Nikkaji Number: J874.966C
• Wikidata: Q83050143
• Mol file: 2491-31-8.mol

Synonyms:1-(2-hydroxyphenyl)-2-phenylethanone;2491-31-8;2-hydroxydeoxybenzoin;1-(2-Hydroxyphenyl)-2-phenylethan-1-one;Acetophenone, 2'-hydroxy-2-phenyl-;BENZYL 2-HYDROXYPHENYL KETONE;Ethanone, 1-(2-hydroxyphenyl)-2-phenyl-;SCHEMBL8376;DTXSID70179616;VGHVJQXWDXRTRJ-UHFFFAOYSA-N;MFCD00218589;Acetophenone, 2'-hydroxy-2-phenyl-,;AS-64062;2'-Hydroxy-2-phenylacetophenone, AldrichCPR;B4673;CS-0315009;FT-0686241;T70645

Chemical Property of 1-(2-Hydroxyphenyl)-2-phenylethanone

Chemical Property:

• Vapor Pressure: 2.22E-05mmHg at 25°C
• Melting Point: 55.0 to 59.0 °C
• Boiling Point: 350.1°C at 760 mmHg
• Flash Point: 149.2°C
• PSA: 37.30000
• Density: 1.178g/cm³
• LogP: 2.81760
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 212.083729621
• Heavy Atom Count: 16
• Complexity: 231

Purity/Quality:

98%min ^*data from raw suppliers

Benzyl 2-Hydroxyphenyl Ketone >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC(=O)C2=CC=CC=C2O

Technology Process of 1-(2-Hydroxyphenyl)-2-phenylethanone

There total 47 articles about 1-(2-Hydroxyphenyl)-2-phenylethanone 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: 100.0%

phenyl phenylacetate (722-01-0) → 2-hydroxy-deoxybenzoin (2491-31-8)

Guidance literature:

With Nafion-Na⁽¹⁺⁾ 117 membrane; In water; for 7h; Irradiation;

DOI:10.1016/S0040-4039(98)80037-3

Reference yield: 99.0%

4-hydroxy-3-phenylcoumarin (1786-05-6) → 2-hydroxy-deoxybenzoin (2491-31-8)

Guidance literature:

With sodium hydroxide; In water; at 140 ℃; for 0.166667h; Temperature; Sealed tube; Microwave irradiation; Green chemistry;

DOI:10.1248/cpb.c13-00604

Reference yield: 87.0%

1-(2-methoxyphenyl)-2-phenylethanone (33470-10-9) → 2-hydroxy-deoxybenzoin (2491-31-8)

Guidance literature:

With boron tribromide; In dichloromethane; at -20 - 20 ℃; for 1h; chemoselective reaction;

DOI:10.1002/bkcs.10806

upstream raw materials:

phenyl phenylacetate

1-(2-methoxyphenyl)-2-phenylethanone

3-(2-methoxy-phenyl)-3-oxo-2-phenyl-propionitrile

3-(2-methoxy-phenyl)-3-oxo-2-phenyl-propionic acid ethyl ester

Downstream raw materials:

2-methyl-3-phenyl-4H-1-benzopyran-4-one

7-benzylsalicydene-aniline

7-benzylsalicylidene-m-toluidine

C₂₁H₂₁NO₄

Refernces

• 1、 Clarkson, Guy J.,Wills, Martin,Zheng, Ye. "Asymmetric Transfer Hydrogenation of o-Hydroxyphenyl Ketones: Utilizing Directing Effects That Optimize the Asymmetric Synthesis of Challenging Alcohols". supporting information. . Retrieved 2020/05/05.
• 2、 Hu, Le' an,Zhang, Yao,Zhang, Qing-Wen,Yin, Qin,Zhang, Xumu. "Ruthenium-Catalyzed Direct Asymmetric Reductive Amination of Diaryl and Sterically Hindered Ketones with Ammonium Salts and H2". . p. 5321 - 5325. Retrieved 2020/02/28.