Agrimophol

Base Information

• Chemical Name: Agrimophol
• CAS No.: 65792-05-4
• Molecular Formula: C₂₆H₃₄O₈
• Molecular Weight: 474.551
• DSSTox Substance ID: DTXSID20984297
• Nikkaji Number: J2.774.592J
• Wikidata: Q27105699
• Mol file: 65792-05-4.mol

Synonyms:agrimophol

Chemical Property of Agrimophol

Chemical Property:

• Vapor Pressure: 5.3E-21mmHg at 25°C
• Refractive Index: 1.588
• Boiling Point: 713 °C at 760 mmHg
• PKA: 4.50±1.00(Predicted)
• Flash Point: 236.8 °C
• PSA: 141.36000
• Density: 1.265 g/cm³
• LogP: 4.78840
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 474.22536804
• Heavy Atom Count: 34
• Complexity: 887

Purity/Quality:

95-99% ^*data from raw suppliers

AGRIMOPHOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)C1=C(C(=C(C(=C1O)CC2(C(=C(C(=C(C2=O)C(=O)C(C)CC)O)C)O)C)O)C)OC
• Isomeric SMILES: CCCC(=O)C1=C(C(=C(C(=C1O)C[C@]2(C(=C(C(=C(C2=O)C(=O)[C@H](C)CC)O)C)O)C)O)C)OC
• Description: This substance is the active ingredient of agrimony, the dry part above the ground of Agrimonia pilosa Ledeb, which is distributed in most areas of China. Its same generic plants include Agrimonia pilosa Ldb. var. nepalensis (D.Don) Nakai, Agrimonia nipponica Koidz. var. occidentalis Skalicky, Agrimonia coreana Nakai, and Agrimonia eupatoria Linn. subsp. asiatica (Juzep.) Skalicky. In recent years, the role of agrimony in the treatment of cancer diseases and other aspects of attention has gradually attracted much attention.Agrimony also contains volatile oil, trace elements, agrimarin, agrimus lactone, tannin, sterols, organic acids, phenolic compounds, flavonoids and glycosides, and other compounds. Among them, the phenolic compounds mainly contain agrimony A, agrimony B, agrimony C, agrimony D, agrimony E, agrimony, pseudoephedrine, and so on.
• Physical properties: Appearance: light yellow-green oblique prism. Solubility: soluble in chloroform and benzene and slightly soluble in methanol, ethanol, and petroleum ether but almost insoluble in water. Melting point: 138.5–139.5?°C.
• Indications: Available in the Pharmacopoeia of the People’s Republic of China (1977). Capsules, suitable for the treatment of tapeworm and trichomonas infection.
• Clinical Use: Agrimophol is clinically used to expel tenia and roundworms and kill schistosomiasis.

Technology Process of Agrimophol

There total 1 articles about Agrimophol 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:

→ agrimophol (65792-05-4,151003-83-7)

Guidance literature:

2-Methoxy-3-butyryl-4.6-dihydroxy-toluol (VI), 1) 2.4.6-Trihydroxy-5-(α-methyl-butyryl)-m-xylol (VIII), Formaldehyd, konz. H2SO4 (katalyt. Wirkung), 2.) Ethanol-CHCl3, 3.) IR-Lampe;