Bis(2,3,4-trihydroxyphenyl)methanone

Base Information

• Chemical Name: Bis(2,3,4-trihydroxyphenyl)methanone
• CAS No.: 75440-84-5
• Molecular Formula: C13H10O7
• Molecular Weight: 278.2143
• NSC Number: 85474
• DSSTox Substance ID: DTXSID10292777
• Wikidata: Q82031218

Synonyms:bis(2,3,4-trihydroxyphenyl)methanone;75440-84-5;NSC85474;NCIOpen2_005059;SCHEMBL1063407;DTXSID10292777;NSC-85474

Chemical Property of Bis(2,3,4-trihydroxyphenyl)methanone

Chemical Property:

• Vapor Pressure: 1.26E-14mmHg at 25°C
• Boiling Point: 592.3°Cat760mmHg
• Flash Point: 326.1°C
• Density: 1.759g/cm³
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 278.04265265
• Heavy Atom Count: 20
• Complexity: 329

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1C(=O)C2=C(C(=C(C=C2)O)O)O)O)O)O

Technology Process of Bis(2,3,4-trihydroxyphenyl)methanone

There total 1 articles about Bis(2,3,4-trihydroxyphenyl)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:

2,3,4-trihydroxybenzoic acid (610-02-6) + 2-hydroxyresorcinol (87-66-1) → exifone (75440-84-5)

Guidance literature:

With zinc(II) chloride; at 125 - 140 ℃;

DOI:10.1021/ja01179a024

Reference yield: 94.0%

exifone (75440-84-5) → 3,4,5,6-tetrahydroxy-9H-xanthen-9-one (99420-08-3)

Guidance literature:

With sodium acetate; In water; for 0.25h; Microwave irradiation;

DOI:10.1080/00397911.2011.573170

Reference yield:

exifone (75440-84-5) + dimethyl sulfate (77-78-1) → bis(2,3,4-trimethoxyphenyl)methanone (32101-34-1)

Guidance literature:

upstream raw materials:

2,3,4-trihydroxybenzoic acid

2-hydroxyresorcinol

Downstream raw materials:

bis(2,3,4-trimethoxyphenyl)methanone

3,4,5,6-tetrahydroxy-9H-xanthen-9-one

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