2H-Isoindole-2-butanamide, N-(2,6-dimethylphenyl)-1,3-dihydro-1,3-dioxo-

Base Information

Chemical Name:2H-Isoindole-2-butanamide, N-(2,6-dimethylphenyl)-1,3-dihydro-1,3-dioxo-
CAS No.:77470-77-0
Molecular Formula:C₂₀H₂₀N₂O₃
Molecular Weight:336.39
Hs Code.:
DSSTox Substance ID:DTXSID201153301
ChEMBL ID:CHEMBL227068

Synonyms:77470-77-0;2H-Isoindole-2-butanamide, N-(2,6-dimethylphenyl)-1,3-dihydro-1,3-dioxo-;CHEMBL227068;DTXSID201153301;STK862488;AKOS002169854;SR-01000260457;SR-01000260457-1;Z27073603;N-(2,6-Dimethylphenyl)-1,3-dihydro-1,3-dioxo-2H-isoindole-2-butanamide;N-(2,6-dimethylphenyl)-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamide

Suppliers and Price of 2H-Isoindole-2-butanamide, N-(2,6-dimethylphenyl)-1,3-dihydro-1,3-dioxo-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 2H-Isoindole-2-butanamide, N-(2,6-dimethylphenyl)-1,3-dihydro-1,3-dioxo-

Chemical Property:

XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:336.14739250
Heavy Atom Count:25
Complexity:499

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=C(C(=CC=C1)C)NC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Technology Process of 2H-Isoindole-2-butanamide, N-(2,6-dimethylphenyl)-1,3-dihydro-1,3-dioxo-

There total 4 articles about 2H-Isoindole-2-butanamide, N-(2,6-dimethylphenyl)-1,3-dihydro-1,3-dioxo- 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: 58.0%

: 3130-75-4
4-phthalimidobutyric acid

: 87-62-7
2,6-dimethylaniline

: 77470-77-0
N-(2,6-dimethylphenyl)-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamide

Guidance literature:: With dicyclohexyl-carbodiimide; In dichloromethane; at 0 - 3 ℃;
DOI:10.1016/j.ejmech.2006.08.010

Reference yield: 44.0%

: 1074-82-4
potassium phtalimide

: 77470-76-9
4-chlorobutyro-2',6'-xylidide

: 77470-81-6
1-(2,6-dimethylphenyl)pyrrolidin-2-one

: 77470-77-0
N-(2,6-dimethylphenyl)-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamide

Guidance literature:: In N,N-dimethyl-formamide; for 2h; Title compound not separated from byproducts; Heating;
DOI:10.1021/jm00139a007

Reference yield:

: 77470-78-1
5-chloropentano-2',6'-xylidide

: 77470-77-0
N-(2,6-dimethylphenyl)-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamide

Guidance literature:: Multi-step reaction with 3 steps

1: NaI / ethanol / 48 h / Heating

2: 73 percent / NaOAc*3H₂O / acetic acid; H₂O / 0.5 h

3: 44 percent / dimethylformamide / 2 h / Heating

With sodium acetate; sodium iodide; In ethanol; water; acetic acid; N,N-dimethyl-formamide;
DOI:10.1021/jm00139a007