Imidodicarbonic acid, (2,5-difluorophenyl)-, 1,1-dimethylethyl methyl ester

Base Information

Chemical Name:Imidodicarbonic acid, (2,5-difluorophenyl)-, 1,1-dimethylethyl methyl ester
CAS No.:129589-72-6
Molecular Formula:C₁₃H₁₅F₂NO₄
Molecular Weight:287.263
Hs Code.:
DSSTox Substance ID:DTXSID501144290

Synonyms:DTXSID501144290;Imidodicarbonic acid, (2,5-difluorophenyl)-, 1,1-dimethylethyl methyl ester;129589-72-6

Suppliers and Price of Imidodicarbonic acid, (2,5-difluorophenyl)-, 1,1-dimethylethyl methyl ester

Supply Marketing:

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

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Chemical Property of Imidodicarbonic acid, (2,5-difluorophenyl)-, 1,1-dimethylethyl methyl ester

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:287.09691428
Heavy Atom Count:20
Complexity:370

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N(C1=C(C=CC(=C1)F)F)C(=O)OC

Technology Process of Imidodicarbonic acid, (2,5-difluorophenyl)-, 1,1-dimethylethyl methyl ester

There total 2 articles about Imidodicarbonic acid, (2,5-difluorophenyl)-, 1,1-dimethylethyl methyl ester 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:

: 2991-28-8,255875-51-5
2,5-difluorobenzoic acid

: 129589-72-6
N-(tert-Butoxycarbonyl)-2,5-difluoro-N-(methoxycarbonyl)aniline

Guidance literature:: Multi-step reaction with 2 steps

1: 81 percent / diphenylphosphorylazide, Et₃N / 2 h / Heating

2: 1) butyllithium, 2) TMEDA / THF, -78 deg C, 30 min

With n-butyllithium; N,N,N,N,-tetramethylethylenediamine; diphenylphosphoranyl azide; triethylamine;
DOI:10.1055/s-1990-26856

Reference yield:

: 129589-71-5
N-(tert-Butoxycarbonyl)-2,5-difluoroaniline

: 79-22-1
methyl chloroformate

: 129589-72-6
N-(tert-Butoxycarbonyl)-2,5-difluoro-N-(methoxycarbonyl)aniline

Guidance literature:: With n-butyllithium; N,N,N,N,-tetramethylethylenediamine; Yield given. Multistep reaction; THF, -78 deg C, 30 min;
DOI:10.1055/s-1990-26856