Methyl alpha-(3-methylphenyl)isobutyrate

Base Information

Chemical Name:Methyl alpha-(3-methylphenyl)isobutyrate
CAS No.:32454-26-5
Molecular Formula:C₁₂H₁₆O₂
Molecular Weight:192.258
Hs Code.:
DSSTox Substance ID:DTXSID501290542
Nikkaji Number:J1.824.132C

Synonyms:32454-26-5;methyl alpha-(3-methylphenyl)isobutyrate;Methyl 2-methyl-2-(3-methylphenyl)propanoate;SCHEMBL12569583;DTXSID501290542;Methyl alpha,alpha,3-trimethylbenzeneacetate;2-(3-Methylphenyl)isobutyric acid methyl ester

Suppliers and Price of Methyl alpha-(3-methylphenyl)isobutyrate

Supply Marketing:

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

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Chemical Property of Methyl alpha-(3-methylphenyl)isobutyrate

Chemical Property:

XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:192.115029749
Heavy Atom Count:14
Complexity:208

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC(=CC=C1)C(C)(C)C(=O)OC

Technology Process of Methyl alpha-(3-methylphenyl)isobutyrate

There total 3 articles about Methyl alpha-(3-methylphenyl)isobutyrate 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: 97.0%

: 547-63-7,133320-07-7,67505-84-4
Methyl isobutyrate

: 591-17-3
meta-bromotoluene

: 32454-26-5
methyl α-(3-methylphenyl)isobutyrate

Guidance literature:: With tri-tert-butyl phosphine; lithium dicyclohexylamide; bis(dibenzylideneacetone)-palladium⁽⁰⁾; In toluene; at 20 ℃; for 24h;
DOI:10.1021/ja027643u

Reference yield: 70.0%

: 53088-69-0
methyl 3-methylphenylacetate

: 74-88-4
methyl iodide

: 32454-26-5
methyl α-(3-methylphenyl)isobutyrate

Guidance literature:: methyl 3-methylphenylacetate; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; at 0 ℃; for 1h;

methyl iodide; In N,N-dimethyl-formamide; mineral oil; at 20 ℃; for 16h;

Reference yield: 60.0%

: 6651-34-9
2-methyl-1-(trimethylsilyloxy)-1-propene

: 591-17-3
meta-bromotoluene

: 32454-26-5
methyl α-(3-methylphenyl)isobutyrate

Guidance literature:: With zinc(II) fluoride; tri-tert-butyl phosphine; bis(dibenzylideneacetone)-palladium⁽⁰⁾; In N,N-dimethyl-formamide; at 80 ℃; for 18h; Sealed tube; Inert atmosphere;
DOI:10.1021/acs.orglett.7b00958