2-Iodo-5-isopropoxy-4-methoxybenzaldehyde

Base Information

• Chemical Name: 2-Iodo-5-isopropoxy-4-methoxybenzaldehyde
• CAS No.: 200941-15-7
• Molecular Formula: C₁₁H₁₃IO₃
• Molecular Weight: 320.127
• DSSTox Substance ID: DTXSID60455577
• Nikkaji Number: J938.540A
• Wikidata: Q82277648
• Mol file: 200941-15-7.mol

Synonyms:2-Iodo-5-isopropoxy-4-methoxybenzaldehyde;200941-15-7;SCHEMBL661869;DTXSID60455577;ABFXAWUBURKXCT-UHFFFAOYSA-N;2-iodo-5-isopropoxy-4methoxybenzaldehyde;2-iodo5-isopropoxy-4-methoxybenzaldehyde;2-Iodo-4-methoxy-5-isopropoxybenzaldehyde

Chemical Property of 2-Iodo-5-isopropoxy-4-methoxybenzaldehyde

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 319.99094
• Heavy Atom Count: 15
• Complexity: 208

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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

Technology Process of 2-Iodo-5-isopropoxy-4-methoxybenzaldehyde

There total 4 articles about 2-Iodo-5-isopropoxy-4-methoxybenzaldehyde 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: 95.0%

O-isopropylisovanillin (34123-66-5) → 2-iodo-5-isopropoxy-4-methoxybenzaldehyde (200941-15-7)

Guidance literature:

With iodine; silver trifluoroacetate; In dichloromethane; for 12h; Heating;

DOI:10.1016/S0968-0896(02)00237-7

Reference yield:

isovanillin (621-59-0) → 2-iodo-5-isopropoxy-4-methoxybenzaldehyde (200941-15-7)

Guidance literature:

Multi-step reaction with 2 steps

1: K₂CO₃ / dimethylformamide / 19 h / 18 °C

2: 93 percent / AgOCOCF₃, I₂ / CHCl₃ / 7 h / Heating

With iodine; silver trifluoroacetate; potassium carbonate; In chloroform; N,N-dimethyl-formamide;

DOI:10.1039/a705874h

Reference yield:

isovanillin (621-59-0) → 2-iodo-5-isopropoxy-4-methoxybenzaldehyde (200941-15-7)

Guidance literature:

Multi-step reaction with 2 steps

1: 94 percent / K₂CO₃ / dimethylformamide / 48 h / 20 °C

2: 95 percent / silver trifluoroacetate; iodine / CH₂Cl₂ / 12 h / Heating

With iodine; silver trifluoroacetate; potassium carbonate; In dichloromethane; N,N-dimethyl-formamide;

DOI:10.1016/S0968-0896(02)00237-7

upstream raw materials:

O-isopropylisovanillin

isovanillin

Downstream raw materials:

14-(3,4-dihydroxyphenyl)-2,3,11,12-tetrahydroxy-6H-chromeno[4′,3′:4,5]pyrrolo[2,1-a]isoquinolin-6-one

5-isopropoxy-2-[2'-(3''-isopropoxy-4''-methoxyphenyl)ethynyl]-4-methoxyphenol

formic acid 5-isopropoxy-2-(3-isopropoxy-4-methoxy-phenylethynyl)-4-methoxy-phenyl ester

1-(α-Iodoacetoxy)-2-[(3-isopropoxy-4-methoxy-phenyl)ethynyl]-5-isopropoxy-4-methoxybenzene