Maclurin

Base Information

• Chemical Name: Maclurin
• CAS No.: 519-34-6
• Molecular Formula: C13H10O6
• Molecular Weight: 262.219
• Hs Code.: 2914501900
• European Community (EC) Number: 208-268-2
• NSC Number: 83240
• UNII: 27KFF3PMTU
• DSSTox Substance ID: DTXSID8060163
• Nikkaji Number: J182.278K
• Wikidata: Q27107278
• Metabolomics Workbench ID: 45675
• ChEMBL ID: CHEMBL506731
• Mol file: 519-34-6.mol

Synonyms:maclura pomifera lectin;maclurin

Chemical Property of Maclurin

Chemical Property:

• Melting Point: 222°C
• Refractive Index: 1.4580 (estimate)
• Boiling Point: 551.1 °C at 760 mmHg
• PKA: 6.75±0.40(Predicted)
• Flash Point: 301.2 °C
• PSA: 118.22000
• Density: 1.641 g/cm³
• LogP: 1.44560
• Storage Temp.: 2-8°C
• Water Solubility.: 5g/L(14 oC)
• XLogP3: 2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 262.04773803
• Heavy Atom Count: 19
• Complexity: 321

Purity/Quality:

98%,99%, ^*data from raw suppliers

Maclurin 95+% ^*data from reagent 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=C2O)O)O)O)O
• Uses: Dyeing fabrics. 2,3'',4,4'',6-Pentahydroxybenzophenone is a UV absorber.

Technology Process of Maclurin

There total 8 articles about Maclurin 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',4,4',6-pentamethoxybenzophenone (58262-60-5) → maclurin (519-34-6)

Guidance literature:

With aluminium trichloride; toluene; at 120 ℃;

DOI:10.1021/ja01179a024

Reference yield:

3,5-dihydroxyphenol (108-73-6) + 3,4-dihydroxybenzonitrile (17345-61-8) → maclurin (519-34-6)

Guidance literature:

With hydrogenchloride; diethyl ether; zinc(II) chloride; at 50 - 60 ℃; man loest das Reaktionsprodukt in Wasser,neutralisiert die waessr.Loesung mit Ammoniak und kocht sie 2 Stdn_.;

Reference yield:

→ maclurin (519-34-6)

Guidance literature:

With penicillium solitum; water; Sucrose; bei mehrwoechiger Einw_.;

upstream raw materials:

3,5-dihydroxyphenol

3,4-dihydroxybenzonitrile

2,3',4,4',6-pentamethoxybenzophenone

Aromadendrin

Downstream raw materials:

3,5-dihydroxyphenol

3,4-Dihydroxybenzoic acid

carbon dioxide

benzene-1,2-diol

Refernces

• 1、 Fujita, Masao,Inoue, Takao. "BIOSYNTHESIS OF MANGIFERIN IN ANEMARRHENA ASPHODELOIDES BUNGE. II. C-GLUCOSYLATION OF MANGIFERIN". . p. 2482 - 2486. Retrieved 2007/10/02.