Isosativan

Base Information

• Chemical Name: Isosativan
• CAS No.: 3722-59-6
• Molecular Formula: C₁₇H₁₈O₄
• Molecular Weight: 286.328
• DSSTox Substance ID: DTXSID101179689
• Nikkaji Number: J108.092J
• Wikidata: Q105003069
• Metabolomics Workbench ID: 22915
• Mol file: 3722-59-6.mol

Synonyms:Isosativan;2'-Isoflavanol, 4',7-dimethoxy-;2'-Hydroxy-7,4'-dimethoxyisoflavan;5-Methoxy-2-(7-methoxy-3,4-dihydro-2H-chromen-3-yl)phenol;3722-59-6;2-(3,4-Dihydro-7-methoxy-2H-1-benzopyran-3-yl)-5-methoxyphenol;5-methoxy-2-[(3r)-7-methoxy-3,4-dihydro-2h-chromen-3-yl]phenol;CHEBI:174740;DTXSID101179689;2'-hydroxy-4',7-dimethoxyisoflavan;LMPK12080030;5-Methoxy-2-(7-methoxy-3,4-dihydro-2H-chromen-3-yl)phenol #;Phenol, 2-(3,4-dihydro-7-methoxy-2H-1-benzopyran-3-yl)-5-methoxy-

Chemical Property of Isosativan

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 286.12050905
• Heavy Atom Count: 21
• Complexity: 335

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1)C2CC3=C(C=C(C=C3)OC)OC2)O

Technology Process of Isosativan

There total 4 articles about Isosativan 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'-hydroxy-4',7-dimethoxyisoflavan (3722-59-6)

Guidance literature:

With palladium on activated charcoal; acetic acid; at 72 - 76 ℃; Hydrogenation;

Reference yield:

→ 2'-hydroxy-4',7-dimethoxyisoflavan (3722-59-6)

Guidance literature:

With palladium on activated charcoal; acetic acid; at 72 - 76 ℃; inactive dihydrohomopterocarpin; Hydrogenation;

Reference yield:

→ 2'-hydroxy-4',7-dimethoxyisoflavan (3722-59-6)

Guidance literature:

With sodium amalgam; ethanol;

Downstream raw materials:

3,4-dihydro-7-methoxy-3-(2,4,5-trimethoxyphenyl)-2H-1-benzopyran

trans-3,4-dihydro-4,7-dimethoxy-3-(2,4,5-trimethoxyphenyl)-2H-1-benzopyran

2,3-dihydro-7-methoxy-3-(2,4,5-trimethoxyphenyl)-1-benzopyran-4-one