(E)-3-(5-iodo-2-furyl)prop-2-enoic acid

Base Information

• Chemical Name: (E)-3-(5-iodo-2-furyl)prop-2-enoic acid
• CAS No.: 111252-32-5
• Molecular Formula: C₇H₅IO₃
• Molecular Weight: 264.019
• DSSTox Substance ID: DTXSID101251251
• Mol file: 111252-32-5.mol

Synonyms:64186-22-7;(E)-3-(5-iodo-2-furyl)prop-2-enoic acid;111252-32-5;3-(5-Iodo-furan-2-yl)-acrylic acid;3-(5-Iodofuran-2-yl)acrylic acid;2-Propenoic acid, 3-(5-iodo-2-furanyl)-, (E)-;(E)-3-(5-iodofuran-2-yl)acrylic acid;(E)-3-(5-iodofuran-2-yl)prop-2-enoic acid;(2E)-3-(5-iodofuran-2-yl)prop-2-enoic acid;3-(5-iodofuran-2-yl)prop-2-enoic acid;DTXSID101251251;HMS1397P05;MFCD02180669;STK548124;AKOS000114526;CS-0345051;EN300-00054;EN300-367321;Z56792403

Chemical Property of (E)-3-(5-iodo-2-furyl)prop-2-enoic acid

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 263.92834
• Heavy Atom Count: 11
• Complexity: 179

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=C(OC(=C1)I)C=CC(=O)O
• Isomeric SMILES: C1=C(OC(=C1)I)/C=C/C(=O)O

Technology Process of (E)-3-(5-iodo-2-furyl)prop-2-enoic acid

There total 7 articles about (E)-3-(5-iodo-2-furyl)prop-2-enoic 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:

5-iodofuran-2-carbaldehyde (2689-65-8) + acetic anhydride (108-24-7) → 2-Iod-5-<2-carboxy-ethylen>-furan (111252-32-5,64186-22-7)

Guidance literature:

With potassium acetate; at 150 ℃;

Reference yield:

5-bromo-2-furancarboxaldehyde (1899-24-7) → 2-Iod-5-<2-carboxy-ethylen>-furan (111252-32-5,64186-22-7)

Guidance literature:

Multi-step reaction with 3 steps

1: potassium acetate / 140 °C

2: sulfuric acid

3: potassium iodide; copper (II)-sulfate; acetic acid / Bestrahlung mit Sonnenlicht

With sulfuric acid; potassium acetate; copper(II) sulfate; acetic acid; potassium iodide;

Reference yield:

trans-3-(5-bromofuran-2-yl)propenoic acid (111252-31-4,64154-10-5) → 2-Iod-5-<2-carboxy-ethylen>-furan (111252-32-5,64186-22-7)

Guidance literature:

Multi-step reaction with 2 steps

1: sulfuric acid

2: potassium iodide; copper (II)-sulfate; acetic acid / Bestrahlung mit Sonnenlicht

With sulfuric acid; copper(II) sulfate; acetic acid; potassium iodide;

upstream raw materials:

5-iodofuran-2-carbaldehyde

acetic anhydride

3-(5-bromo-furan-2-yl)-acrylic acid methyl ester

copper(II) sulfate