2-Hydroxy-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoic acid

Base Information

• Chemical Name: 2-Hydroxy-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoic acid
• CAS No.: 7069-47-8
• Molecular Formula: C₁₅H₁₀I₄O₅
• Molecular Weight: 777.859
• UNII: 9J979R8YV9
• DSSTox Substance ID: DTXSID40519489
• Mol file: 7069-47-8.mol

Synonyms:7069-47-8;3,5,3',5'-Tetraiodo Thyrolactic Acid;2-Hydroxy-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoic acid;9J979R8YV9;UNII-9J979R8YV9;Benzenepropanoic acid, alpha-hydroxy-4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodo-;2-Hydroxy-3-(4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl)propanoic acid;DTXSID40519489;3,5,3',5'-Tetraiodo Thyrolactic Acid (~90%)

Chemical Property of 2-Hydroxy-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoic acid

Chemical Property:

• PSA: 86.99000
• LogP: 4.59090
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 777.6707
• Heavy Atom Count: 24
• Complexity: 416

Purity/Quality:

95%+ or 98%+ ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)I)I)CC(C(=O)O)O
• Uses: 3,5,3'',5''-Tetraiodo Thyrolactic Acid is a thyroid hormone analogue. A Thyroxine (T425600) analogue.

Technology Process of 2-Hydroxy-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoic acid

There total 2 articles about 2-Hydroxy-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoic acid 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:

→ 3,5,3',5',-Tetraiod-thyromilchsaeure (7069-47-8)

Guidance literature:

With sodium hydroxide; oxygen; butan-1-ol; pH 8.8;

Reference yield:

→ 3,5,3',5',-Tetraiod-thyromilchsaeure (7069-47-8)

Guidance literature:

4-Hydroxy-3,5-diiod-phenyl-brenztraubensaeure (I), 3-(4-Hydroxy-3,5-diiod-phenyl)-milchsaeure (IIh), wss. Pufferloesg./Butanol, pH 7.6, Einleiten von O2;