1-(2,6-Dihydroxy-4-methoxyphenyl)-3-phenylpropan-1-one

Base Information

• Chemical Name: 1-(2,6-Dihydroxy-4-methoxyphenyl)-3-phenylpropan-1-one
• CAS No.: 35241-55-5
• Molecular Formula: C16H16O4
• Molecular Weight: 272.301
• Hs Code.: 2914509090
• European Community (EC) Number: 252-459-3
• UNII: EEW35E6HOL
• DSSTox Substance ID: DTXSID80188734
• Nikkaji Number: J289.946I
• Wikidata: Q27103754
• Metabolomics Workbench ID: 26986
• ChEMBL ID: CHEMBL486009
• Mol file: 35241-55-5.mol

Synonyms:2',6'-dihydroxy-4'-methoxydihydro-chalcone;2',6'-dihydroxy-4'-methoxydihydrochalcone

Chemical Property of 1-(2,6-Dihydroxy-4-methoxyphenyl)-3-phenylpropan-1-one

Chemical Property:

• Vapor Pressure: 3.62E-10mmHg at 25°C
• Boiling Point: 488.5°Cat760mmHg
• Flash Point: 183.4°C
• PSA: 66.76000
• Density: 1.243g/cm³
• LogP: 2.92190
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 272.10485899
• Heavy Atom Count: 20
• Complexity: 300

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C(=C1)O)C(=O)CCC2=CC=CC=C2)O

Technology Process of 1-(2,6-Dihydroxy-4-methoxyphenyl)-3-phenylpropan-1-one

There total 11 articles about 1-(2,6-Dihydroxy-4-methoxyphenyl)-3-phenylpropan-1-one 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: 97.0%

1-(2,6-dihydroxy-4-methoxyphenyl)-3-phenyl-2-propen-1-one (77129-49-8) → 1-(2,6-dihydroxy-4-methoxy-phenyl)-3-phenyl-propan-1-one (35241-55-5)

Guidance literature:

With 5%-palladium/activated carbon; hydrogen; In methanol; ethyl acetate; at 20 ℃; for 2h; Inert atmosphere;

DOI:10.1021/acs.joc.5b00331

Reference yield: 92.0%

tectochrysine (520-28-5) → 1-(2,6-dihydroxy-4-methoxy-phenyl)-3-phenyl-propan-1-one (35241-55-5)

Guidance literature:

tectochrysine; With palladium 10% on activated carbon; ammonium formate; In ethanol; for 2h; Reflux;

With hydrogenchloride; In water;

DOI:10.1002/ejoc.201400104

Reference yield: 57.0%

tectochrysine (520-28-5) → 1-(2,6-dihydroxy-4-methoxy-phenyl)-3-phenyl-propan-1-one (35241-55-5) + pinostrobin (75291-74-6,163660-09-1)

Guidance literature:

With 1% Pd/C; hydrogen; In ethyl acetate; at 20 ℃; for 24h;

DOI:10.1016/j.bmcl.2010.03.054

upstream raw materials:

pinostrobin

dimethyl sulfate

tectochrysine

Dimethyl-chrysin

Downstream raw materials:

piperaduncin C

(+)-hostmanin A