Diethyl[(2-methyl-1h-indol-3-yl)methyl]malonate

Base Information

• Chemical Name: Diethyl[(2-methyl-1h-indol-3-yl)methyl]malonate
• CAS No.: 6637-12-3
• Molecular Formula: C17H21NO4
• Molecular Weight: 303.3529
• NSC Number: 52363
• DSSTox Substance ID: DTXSID50287748
• Wikidata: Q82023886

Synonyms:6637-12-3;diethyl[(2-methyl-1h-indol-3-yl)methyl]malonate;NSC52363;DTXSID50287748;NSC-52363;STK831335;AKOS000549723;CCG-111111;EU-0010673;SR-01000485895;SR-01000485895-1;Diethyl 2-((2-methyl-1H-indol-3-yl)methyl)malonate;diethyl [(2-methyl-1H-indol-3-yl)methyl]propanedioate;1,3-DIETHYL 2-[(2-METHYL-1H-INDOL-3-YL)METHYL]PROPANEDIOATE

Chemical Property of Diethyl[(2-methyl-1h-indol-3-yl)methyl]malonate

Chemical Property:

• Vapor Pressure: 4.66E-08mmHg at 25°C
• Boiling Point: 443.4°Cat760mmHg
• Flash Point: 221.9°C
• PSA: 68.39000
• Density: 1.178g/cm³
• LogP: 2.76120
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 303.14705815
• Heavy Atom Count: 22
• Complexity: 380

Purity/Quality:

99% ^*data from raw suppliers

DIETHYL 2-[(2-METHYL-1H-INDOL-3-YL)METHYL]PROPANEDIOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(CC1=C(NC2=CC=CC=C21)C)C(=O)OCC

Technology Process of Diethyl[(2-methyl-1h-indol-3-yl)methyl]malonate

There total 3 articles about Diethyl[(2-methyl-1h-indol-3-yl)methyl]malonate 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-methylgramine (37125-92-1) + diethyl malonate (105-53-3) → diethyl 2-((2-methyl-1H-indol-3-yl)methyl)malonate (6637-12-3)

Guidance literature:

With propynoic acid ethyl ester; In tetrahydrofuran; at 20 ℃; for 12h; Inert atmosphere;

DOI:10.1002/anie.201904557

Reference yield:

2-methyl-1H-indole (95-20-5) → diethyl 2-((2-methyl-1H-indol-3-yl)methyl)malonate (6637-12-3)

Guidance literature:

Multi-step reaction with 2 steps

1.1: acetic acid / water; 1,4-dioxane / 0.08 h / 0 °C / Inert atmosphere

1.2: 7 h / 0 - 20 °C / Inert atmosphere

2.1: propynoic acid ethyl ester / tetrahydrofuran / 12 h / 20 °C / Inert atmosphere

With acetic acid; propynoic acid ethyl ester; In tetrahydrofuran; 1,4-dioxane; water;

DOI:10.1002/anie.201904557

Reference yield:

→ diethyl 2-((2-methyl-1H-indol-3-yl)methyl)malonate (6637-12-3)

Guidance literature:

Skatolverb., Malonester;

upstream raw materials:

2-methyl-1H-indole

2-methylgramine

diethyl malonate

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 6637-12-3 diethyl [(2-methyl-1H-indol-3-yl)methyl]propanedioate

Send

Send

Metric Ton KG G Pound L ML

Send

Send