4-Formyl-2-iodo-6-methoxyphenyl acetate

Base Information

• Chemical Name: 4-Formyl-2-iodo-6-methoxyphenyl acetate
• CAS No.: 486994-14-3
• Molecular Formula: C10H9IO4
• Molecular Weight: 320.084
• DSSTox Substance ID: DTXSID101267993
• Mol file: 486994-14-3.mol

Synonyms:4-formyl-2-iodo-6-methoxyphenyl acetate;486994-14-3;(4-formyl-2-iodo-6-methoxyphenyl) acetate;4-(acetyloxy)-3-iodo-5-methoxybenzaldehyde;SCHEMBL668507;DTXSID101267993;MFCD02257182;STK348903;AKOS000303893;4-formyl-2-iodo-6-methoxyphenylacetate;4-formyl-6-methoxy-2-iodophenyl acetate;LS-08973;EN300-228087;AN-655/15531022;SR-01000263032;SR-01000263032-1

Chemical Property of 4-Formyl-2-iodo-6-methoxyphenyl acetate

Chemical Property:

• PSA: 52.60000
• LogP: 2.03760
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 319.95456
• Heavy Atom Count: 15
• Complexity: 244

Purity/Quality:

4-Formyl-2-iodo-6-methoxyphenyl acetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1=C(C=C(C=C1I)C=O)OC

Technology Process of 4-Formyl-2-iodo-6-methoxyphenyl acetate

There total 5 articles about 4-Formyl-2-iodo-6-methoxyphenyl 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: 99.13%

5-iodovaniline (5438-36-8) + acetic anhydride (108-24-7) → 4-(acetyloxy)-3-iodo-5-methoxybenzaldehyde (486994-14-3)

Guidance literature:

With sulfuric acid; at 20 ℃; for 4h;

DOI:10.1016/j.ejmech.2013.05.001

Reference yield: 96.0%

5-iodovaniline (5438-36-8) + acetyl chloride (75-36-5) → 4-(acetyloxy)-3-iodo-5-methoxybenzaldehyde (486994-14-3)

Guidance literature:

With triethylamine; In tetrahydrofuran; at 0 ℃;

Reference yield: 81.0%

vanillin acetate (881-68-5) → 4-(acetyloxy)-3-iodo-5-methoxybenzaldehyde (486994-14-3)

Guidance literature:

With Iodine monochloride; acetic acid; at 40 - 45 ℃; for 4h;

upstream raw materials:

5-iodovaniline

acetyl chloride

vanillin acetate

vanillin

Downstream raw materials:

4-Acetoxy-3-iodo-5-methoxy-benzoic acid

1-[3-methoxy-4-(4-chlorophenylthioethoxy)-5-iodophenyl]prop-2-en-1-one

1-(3-methoxy-4-hydroxy-5-iodophenyl)-prop-2-en-1-one

1-[4-(2-bromo-ethoxy)-3-iodo-5-methoxy-phenyl]-propenone