Benzene, 1-bromo-2-methoxy-3-(1-methylethyl)-

Base Information

Chemical Name:Benzene, 1-bromo-2-methoxy-3-(1-methylethyl)-
CAS No.:129976-33-6
Molecular Formula:C10H13BrO
Molecular Weight:229.117
Hs Code.:
DSSTox Substance ID:DTXSID10462675
Nikkaji Number:J2.035.416J
Wikidata:Q82287240

Synonyms:129976-33-6;Benzene, 1-bromo-2-methoxy-3-(1-methylethyl)-;2-bromo-6-isopropylanisole;1-bromo-3-isopropyl-2-methoxybenzene;2-bromo-6-isopropylanisol;1-bromo-2-methoxy-3-propan-2-ylbenzene;1-bromo-2-methoxy-3-(propan-2-yl)benzene;SCHEMBL618635;DTXSID10462675;RMYVECCGQUCNMZ-UHFFFAOYSA-N;GS2757

Suppliers and Price of Benzene, 1-bromo-2-methoxy-3-(1-methylethyl)-

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of Benzene, 1-bromo-2-methoxy-3-(1-methylethyl)-

Chemical Property:

XLogP3:3.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:228.01498
Heavy Atom Count:12
Complexity:136

Purity/Quality:: 98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Benzene, 1-bromo-2-methoxy-3-(1-methylethyl)-

There total 6 articles about Benzene, 1-bromo-2-methoxy-3-(1-methylethyl)- 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: 92.0%

: 88-69-7
2-(1-methylethyl)phenol

: 77-78-1
dimethyl sulfate

: 129976-33-6
1-bromo-3-isopropyl-2-methoxybenzene

Guidance literature:: With lithium hydroxide; benzyltri(n-butyl)ammonium chloride; In dichloromethane; at 20 ℃; for 12h;
DOI:10.1055/s-2002-34373

Reference yield: 79.0%

: 1-bromo-2-methoxy-3-(prop-1-en-2-yl)benzene

: 7-bromo-3,3-dimethyl-2,3-dihydrobenzofuran

: 129976-33-6
1-bromo-3-isopropyl-2-methoxybenzene

Guidance literature:: With (S)-(+)-5,5’-bis[di(3,5-di-tert-butyl-4-methoxyphenyl)phosphino]-4,4’-bi-1,3-benzodioxole; di-μ-chlorotetrakis(ethene)diiridium(I); In toluene; at 135 ℃; for 24h; Inert atmosphere; Sealed tube;
DOI:10.1002/adsc.201900749

Reference yield:

: 95-56-7
2-hydroxybromobenzene

: 7-bromo-3,3-dimethyl-2,3-dihydrobenzofuran

: 129976-33-6
1-bromo-3-isopropyl-2-methoxybenzene

Guidance literature:: Multi-step reaction with 5 steps

1.1: triethylamine / dichloromethane / 20 °C / Inert atmosphere

2.1: aluminum (III) chloride / 1,2-dichloro-benzene / 3 h / 140 °C / Inert atmosphere

3.1: tetrahydrofuran; hexane / 2 h / 0 °C / Inert atmosphere

3.2: 20 °C / Inert atmosphere

4.1: potassium carbonate / N,N-dimethyl-d₆-formamide / 2.5 h / 20 °C / Inert atmosphere

5.1: (S)-(+)-5,5’-bis[di(3,5-di-tert-butyl-4-methoxyphenyl)phosphino]-4,4’-bi-1,3-benzodioxole; di-μ-chlorotetrakis(ethene)diiridium(I) / toluene / 24 h / 135 °C / Inert atmosphere; Sealed tube

With (S)-(+)-5,5’-bis[di(3,5-di-tert-butyl-4-methoxyphenyl)phosphino]-4,4’-bi-1,3-benzodioxole; aluminum (III) chloride; di-μ-chlorotetrakis(ethene)diiridium(I); potassium carbonate; triethylamine; In tetrahydrofuran; hexane; dichloromethane; 1,2-dichloro-benzene; toluene; N,N-dimethyl-d₆-formamide;
DOI:10.1002/adsc.201900749