2-(4-Bromophenyl)-1-(2,4-dihydroxyphenyl)ethanone

Base Information

• Chemical Name: 2-(4-Bromophenyl)-1-(2,4-dihydroxyphenyl)ethanone
• CAS No.: 92152-60-8
• Molecular Formula: C14H11 Br O3
• Molecular Weight: 307.144
• European Community (EC) Number: 650-983-0
• DSSTox Substance ID: DTXSID00366274
• Nikkaji Number: J2.492.548J
• Wikidata: Q27186495
• ChEMBL ID: CHEMBL1587804
• Mol file: 92152-60-8.mol

Synonyms:2-(4-bromophenyl)-1-(2,4-dihydroxyphenyl)ethanone;92152-60-8;2-(4-bromophenyl)-1-(2,4-dihydroxyphenyl)ethan-1-one;MLS000113451;SMR000109349;Opera_ID_231;Oprea1_260410;SCHEMBL2331741;CHEMBL1587804;DTXSID00366274;CHEBI:108036;GVDMPWQNNRNDOG-UHFFFAOYSA-N;HMS2185H11;2,4-Dihydroxy-4'-bromodeoxybenzoin;MFCD00499092;STK841186;AKOS000275901;CCG-315448;AS-68134;CS-0060219;FT-0731967;EN300-235875;W17532;A860149;SR-01000251589;SR-01000251589-1;Q27186495;F1190-0469;2-(4-bromophenyl)-1-(2 pound not4-dihydroxyphenyl)ethanone

Chemical Property of 2-(4-Bromophenyl)-1-(2,4-dihydroxyphenyl)ethanone

Chemical Property:

• Vapor Pressure: 6.64E-10mmHg at 25°C
• Melting Point: 176–177°C
• Refractive Index: 1.663
• Boiling Point: 481.7°C at 760 mmHg
• Flash Point: 245.1°C
• PSA: 57.53000
• Density: 1.577g/cm³
• LogP: 3.28570
• Storage Temp.: 2-8°C
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 305.98916
• Heavy Atom Count: 18
• Complexity: 287

Purity/Quality:

97% ^*data from raw suppliers

2-(4-Bromophenyl)-1-(2,4-dihydroxyphenyl)ethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CC(=O)C2=C(C=C(C=C2)O)O)Br

Technology Process of 2-(4-Bromophenyl)-1-(2,4-dihydroxyphenyl)ethanone

There total 5 articles about 2-(4-Bromophenyl)-1-(2,4-dihydroxyphenyl)ethanone 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%

4-Bromophenylacetonitrile (16532-79-9) + recorcinol (108-46-3) → 2-(4-bromophenyl)-1-(2,4-dihydroxyphenyl)ethan-1-one (92152-60-8)

Guidance literature:

With hydrogenchloride; boron trifluoride diethyl etherate; water; 1.) halogen chloride passed 10h, 10h room temperature, 2.) 90 deg C, pH=1, 60 min;

DOI:10.1007/BF00576209

Reference yield: 77.0%

recorcinol (108-46-3) + 2-(4-bromophenyl)-acetic acid (1878-68-8) → 2-(4-bromophenyl)-1-(2,4-dihydroxyphenyl)ethan-1-one (92152-60-8)

Guidance literature:

With boron trifluoride diethyl etherate; at 80 ℃; for 8h; Inert atmosphere;

DOI:10.1016/j.tet.2018.05.003

Reference yield: 27.9%

→ 2-(4-bromophenyl)-1-(2,4-dihydroxyphenyl)ethan-1-one (92152-60-8)

Guidance literature:

upstream raw materials:

4-Bromophenylacetonitrile

recorcinol

2-(4-bromophenyl)-acetic acid

Downstream raw materials:

ethyl 3-(4-bromophenyl)-7-hydroxy-4-oxo-4H-chromene-2-carboxylate

7-hydroxy-3-(4’-bromophenyl)-4H-1-benzopyran-4-one

2-trifluoromethyl-7-hydroxy-4'-bromoisoflavone

Acetic acid (2S,3R,4S,5R,6R)-4,5-diacetoxy-6-acetoxymethyl-2-{4-[2-(4-bromo-phenyl)-acetyl]-3-hydroxy-phenoxy}-tetrahydro-pyran-3-yl ester