(2,3-Dihydroxy-4-methoxyphenyl)(phenyl)methanone

Base Information

• Chemical Name: (2,3-Dihydroxy-4-methoxyphenyl)(phenyl)methanone
• CAS No.: 35836-41-0
• Molecular Formula: C₁₄H₁₂O₄
• Molecular Weight: 244.247
• NSC Number: 113041
• DSSTox Substance ID: DTXSID70296993
• Nikkaji Number: J731.515E
• Wikidata: Q82037880
• Metabolomics Workbench ID: 87227
• ChEMBL ID: CHEMBL1358274
• Mol file: 35836-41-0.mol

Synonyms:(2,3-dihydroxy-4-methoxyphenyl)(phenyl)methanone;3-DESMETHYL-5-DESHYDROXYSCLEROIN;35836-41-0;(2,3-dihydroxy-4-methoxyphenyl)-phenylmethanone;NSC113041;Spectrum_000657;SpecPlus_000347;Spectrum2_000190;Spectrum3_000200;Spectrum4_001517;Spectrum5_000313;SCHEMBL93271;BSPBio_001759;KBioGR_002213;KBioSS_001137;SPECTRUM201083;DivK1c_006443;SPBio_000119;CHEMBL1358274;KBio1_001387;KBio2_001137;KBio2_003705;KBio2_006273;KBio3_001259;DTXSID70296993;CHEBI:165193;2,3-dihydroxy-4-methoxybenzophenone;CCG-40004;NSC-113041;NCGC00095821-01;NCGC00095821-02;PD002198;(2,3-dihydroxy-4-methoxy-phenyl)-phenyl-methanone

Chemical Property of (2,3-Dihydroxy-4-methoxyphenyl)(phenyl)methanone

Chemical Property:

• Vapor Pressure: 1.46E-07mmHg at 25°C
• Boiling Point: 417.4°C at 760 mmHg
• Flash Point: 160.1°C
• Density: 1.296g/cm³
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 244.07355886
• Heavy Atom Count: 18
• Complexity: 286

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of (2,3-Dihydroxy-4-methoxyphenyl)(phenyl)methanone

There total 7 articles about (2,3-Dihydroxy-4-methoxyphenyl)(phenyl)methanone 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: 17.0%

2,3,4-trihydroxybenzophenone (1143-72-2) + methyl iodide (74-88-4) → (2,3-dihydroxy-4-methoxyphenyl)(phenyl)methanone (35836-41-0) + (3,4-dimethoxy-2-hydroxyphenyl)(phenyl)methanone (7508-32-9)

Guidance literature:

With lithium carbonate; In N,N-dimethyl-formamide; at 30 ℃; for 15h;

Reference yield:

2,3,4-trihydroxybenzophenone (1143-72-2) + dimethyl sulfate (77-78-1) → (2,3-dihydroxy-4-methoxyphenyl)(phenyl)methanone (35836-41-0)

Guidance literature:

With sodium hydroxide;

DOI:10.1021/jo01089a016

Reference yield:

methyl iodide (74-88-4) → (2,3-dihydroxy-4-methoxyphenyl)(phenyl)methanone (35836-41-0)

Guidance literature:

at 120 ℃;

upstream raw materials:

2,3,4-trihydroxybenzophenone

dimethyl sulfate

diazomethane

methyl iodide

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