2H-Indol-2-one, 1,3-dihydro-3-(2-methoxyphenyl)-1-methyl-

Base Information

• Chemical Name: 2H-Indol-2-one, 1,3-dihydro-3-(2-methoxyphenyl)-1-methyl-
• CAS No.: 108447-55-8
• Molecular Formula: C16H15NO2
• Molecular Weight: 253.301
• DSSTox Substance ID: DTXSID20441138
• Nikkaji Number: J1.533.349I
• Mol file: 108447-55-8.mol

Synonyms:108447-55-8;2H-Indol-2-one, 1,3-dihydro-3-(2-methoxyphenyl)-1-methyl-;SCHEMBL10368739;DTXSID20441138;AIHLRXPWSPBZNC-UHFFFAOYSA-N;1-methyl-3-(2-methoxyphenyl)indolin-2-one;1-Methyl-3-(2-methoxyphenyl)indoline-2-one;3-(2-methoxyphenyl)-1-methylindolin- -2-one

Chemical Property of 2H-Indol-2-one, 1,3-dihydro-3-(2-methoxyphenyl)-1-methyl-

Chemical Property:

• Melting Point: 106-107 °C
• Boiling Point: 427.2±45.0 °C(Predicted)
• PSA: 29.54000
• Density: 1.182±0.06 g/cm3(Predicted)
• LogP: 2.86850
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 253.110278721
• Heavy Atom Count: 19
• Complexity: 344

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=CC=CC=C2C(C1=O)C3=CC=CC=C3OC

Technology Process of 2H-Indol-2-one, 1,3-dihydro-3-(2-methoxyphenyl)-1-methyl-

There total 4 articles about 2H-Indol-2-one, 1,3-dihydro-3-(2-methoxyphenyl)-1-methyl- 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: 87.0%

N-methyl-2-indolinone (61-70-1) + 2-Methoxyphenylboronic acid (5720-06-9) → 1-methyl-3-(2-methoxyphenyl)oxindole (108447-55-8)

Guidance literature:

With C₃₇H₂₉N₂O₃PPd; potassium hydroxide; In water; at 20 ℃; for 5h; Catalytic behavior; Green chemistry;

DOI:10.1002/cctc.201601411

Reference yield: 60.0%

2-Chloroanisole (766-51-8) + N-(2-bromophenyl)-N-methylacetamide (153704-11-1) → 1-methyl-3-(2-methoxyphenyl)oxindole (108447-55-8)

Guidance literature:

With palladium diacetate; sodium t-butanolate; tricyclohexylphosphine; In 1,4-dioxane; at 70 ℃; for 12h;

DOI:10.1021/jo005761z

Reference yield:

N-methyl-N-phenyl-2-methoxymandelamide → 1-methyl-3-(2-methoxyphenyl)oxindole (108447-55-8)

Guidance literature:

With PPA;

upstream raw materials:

2-Chloroanisole

N-(2-bromophenyl)-N-methylacetamide

N-methyl-2-indolinone

2-Methoxyphenylboronic acid

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