1-[Bromo(difluoro)methyl]-4-tert-butylbenzene

Base Information

Chemical Name:1-[Bromo(difluoro)methyl]-4-tert-butylbenzene
CAS No.:114467-76-4
Molecular Formula:C₁₁H₁₃BrF₂
Molecular Weight:263.125
Hs Code.:
DSSTox Substance ID:DTXSID401220980

Synonyms:1-[bromo(difluoro)methyl]-4-tert-butylbenzene;DTXSID401220980;114467-76-4;1-(Bromodifluoromethyl)-4-(1,1-dimethylethyl)benzene;benzene, 1-(bromodifluoromethyl)-4-(1,1-dimethylethyl)-

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

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Chemical Property of 1-[Bromo(difluoro)methyl]-4-tert-butylbenzene

Chemical Property:

XLogP3:4.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:262.01687
Heavy Atom Count:14
Complexity:188

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)C1=CC=C(C=C1)C(F)(F)Br

Technology Process of 1-[Bromo(difluoro)methyl]-4-tert-butylbenzene

There total 9 articles about 1-[Bromo(difluoro)methyl]-4-tert-butylbenzene 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: 69.0%

: 114467-73-1
1-(difluoromethyl)-4-(1,1-dimethylethyl)benzene

: 114467-76-4
1-(bromodifluoromethyl)-4-(tert-butyl)benzene

Guidance literature:: With bromine; In tetrachloromethane; for 1512h; Irradiation;

Reference yield: 65.0%

: 1-(tert-butyl)-4-(difluoro((trifluoromethyl)sulfonyl)methyl)benzene

: 114467-76-4
1-(bromodifluoromethyl)-4-(tert-butyl)benzene

Guidance literature:: With lithium bromide; In [D₃]acetonitrile; at 80 ℃; for 5h; Schlenk technique; Glovebox;
DOI:10.1021/acs.orglett.1c03803

Reference yield:

: C₁₂H₁₃ClF₂O

: 114467-76-4
1-(bromodifluoromethyl)-4-(tert-butyl)benzene

Guidance literature:: With dmap; Bromotrichloromethane; 2-mercaptopyridine-1-oxide sodium salt; for 12h; Irradiation;
DOI:10.1055/s-0035-1560592