2-Chloro-1-[(4-methoxyphenyl)methyl]indole-3-carbaldehyde

Base Information

• Chemical Name: 2-Chloro-1-[(4-methoxyphenyl)methyl]indole-3-carbaldehyde
• CAS No.: 77655-47-1
• Molecular Formula: C₁₇H₁₄ClNO₂
• Molecular Weight: 299.757
• DSSTox Substance ID: DTXSID401174971
• Nikkaji Number: J1.820.207G

Synonyms:77655-47-1;SCHEMBL8717326;DTXSID401174971;2-Chloro-1-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxaldehyde

Chemical Property of 2-Chloro-1-[(4-methoxyphenyl)methyl]indole-3-carbaldehyde

Chemical Property:

• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 299.0713064
• Heavy Atom Count: 21
• Complexity: 357

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2Cl)C=O

Technology Process of 2-Chloro-1-[(4-methoxyphenyl)methyl]indole-3-carbaldehyde

There total 1 articles about 2-Chloro-1-[(4-methoxyphenyl)methyl]indole-3-carbaldehyde 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:

p-methoxybenzyl chloride (824-94-2) + 2-chloroindole-3-carboxaldehyde (5059-30-3) → 1-(p-metossibenzil)-2-cloroindol-3-carbossialdeide (77655-47-1)

Guidance literature:

With sodium hydride; Yield given. Multistep reaction; 1.) DMF, mineral oil; 2.) DMF;

Reference yield: 81.23%

4-oxo-3,4-dihydroquinazoline-2-carbohydrazide (34632-71-8) + 1-(p-metossibenzil)-2-cloroindol-3-carbossialdeide (77655-47-1) → (E)-N'-((2-chloro-1-(4-methoxybenzyl)-1H-indol-3-yl)methylene)-4-oxo-3,4-dihydroquinazoline-2-carbohydrazide

Guidance literature:

With acetic acid; In ethanol; Reflux;

DOI:10.1002/jhet.3172

Reference yield: 65.0%

1-(p-metossibenzil)-2-cloroindol-3-carbossialdeide (77655-47-1) → 1-(4-methoxybenzyl)-2-chloroindole-3-carboxylic acid (407630-85-7)

Guidance literature:

With potassium permanganate; In water; acetone; at 20 ℃;

DOI:10.1016/S0040-4039(01)02040-8

upstream raw materials:

p-methoxybenzyl chloride

2-chloroindole-3-carboxaldehyde

Downstream raw materials:

1-(4-methoxybenzyl)-2-chloroindole-3-carboxylic acid

2-chloro-1-(4-methoxy-benzyl)-1H-indole-3-carbonyl chloride

2-methoxy-9-(4-methoxybenzyl)-1,3-thiazino[6,5-b]indol-4-one

1-(4-methoxybenzyl)-2-chloroindol-3-ylcarbonyl isothiocyanate

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