Phenol, 2,4-diiodo-, acetate

Base Information

• Chemical Name: Phenol, 2,4-diiodo-, acetate
• CAS No.: 36914-80-4
• Molecular Formula: C8H6I2O2
• Molecular Weight: 387.943
• DSSTox Substance ID: DTXSID50190400
• Nikkaji Number: J323.608K
• Wikidata: Q83062760
• Mol file: 36914-80-4.mol

Synonyms:Phenol, 2,4-diiodo-, acetate;(2,4-diiodophenyl) acetate;36914-80-4;Phenol,2,4-diiodo-,acetate;SCHEMBL196363;DTXSID50190400;Acetic acid 2,4-diiodo-phenyl ester

Chemical Property of Phenol, 2,4-diiodo-, acetate

Chemical Property:

• Vapor Pressure: 4.06E-05mmHg at 25°C
• Boiling Point: 351.6°Cat760mmHg
• Flash Point: 166.4°C
• PSA: 26.30000
• Density: 2.265g/cm³
• LogP: 2.82110
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 387.84572
• Heavy Atom Count: 12
• Complexity: 172

Purity/Quality:

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OC1=C(C=C(C=C1)I)I

Technology Process of Phenol, 2,4-diiodo-, acetate

There total 5 articles about Phenol, 2,4-diiodo-, acetate 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:

2,4-diiodophenol (2012-29-5) + acetyl chloride (75-36-5) → acetic acid 2,4-diiodophenyl ester (36914-80-4)

Guidance literature:

at 100 ℃;

Reference yield:

phenol (108-95-2,27073-41-2) → acetic acid 2,4-diiodophenyl ester (36914-80-4)

Guidance literature:

Multi-step reaction with 2 steps

1: alkali; iodine-potassium iodide

2: 125 °C

With iodine;

Reference yield:

p-Iodophenol (540-38-5) → acetic acid 2,4-diiodophenyl ester (36914-80-4)

Guidance literature:

Multi-step reaction with 2 steps

1: concentrated sulfuric acid / -10 °C

2: 100 °C

With sulfuric acid;

upstream raw materials:

2,4-diiodophenol

acetic anhydride

acetyl chloride

p-Iodophenol

Downstream raw materials:

acetic acid 2-(4-acetoxy-3-phenylethynyl-phenylethynyl)-4-[(triisopropylsilanyl)-ethynyl]-phenyl ester

acetic acid 4-(2-acetoxy-5-ethynyl-phenylethynyl)-2-phenylethynyl-phenyl ester

acetic acid 2-iodo-4-[(triisopropylsilanyl)-ethynyl]-phenyl ester

2-iodophenyl acetate