2-Methyl-2-phenyl-undecane

Base Information

• Chemical Name: 2-Methyl-2-phenyl-undecane
• CAS No.: 35293-37-9
• Molecular Formula: C14H22
• Molecular Weight: 190.329
• UNII: SN65B54QLL
• Nikkaji Number: J2.159.351F
• Wikidata: Q27161377
• Mol file: 35293-37-9.mol

Synonyms:2-methyl-2-phenyl-undecane;2,4,4-trimethylpentan-2-ylbenzene;(1,1,3,3-tetramethylbutyl)benzene;SN65B54QLL;35293-37-9;UNII-SN65B54QLL;27854-40-6;CHEBI:89191;2,2,4-trimethyl-4-phenylpentane;1-Phenyl-1,1,3,3-tetramethylbutane;Q27161377;2-TERT-BUTYL4-METHYL3,5-DIMETHYL-1H-PYRROLE-2,4-DICARBOXYLATE

Chemical Property of 2-Methyl-2-phenyl-undecane

Chemical Property:

• Boiling Point: 241.045 °C at 760 mmHg
• Flash Point: 92.183 °C
• Density: 0.857 g/cm³
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 190.172150702
• Heavy Atom Count: 14
• Complexity: 165

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)CC(C)(C)C1=CC=CC=C1

Technology Process of 2-Methyl-2-phenyl-undecane

There total 15 articles about 2-Methyl-2-phenyl-undecane 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: 65.0%

phosphoric acid diethyl ester 4-(1,1,3,3-tetramethyl-butyl)-phenyl ester → (1,1,3,3-tetramethyl-butyl)-benzene (35293-37-9)

Guidance literature:

With lithium 4,4′-di(tert-butyl)biphenyl; In tetrahydrofuran; at 0 ℃; for 0.0833333h;

DOI:10.1055/s-2005-861790

Reference yield:

aluminium trichloride (7446-70-0) + 2,4,4-trimethyl-2-pentanol (690-37-9) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → tert-butylbenzene (253185-03-4,253185-04-5) + Isobutane (75-28-5,40921-86-6) + (1,1,3,3-tetramethyl-butyl)-benzene (35293-37-9)

Guidance literature:

DOI:10.1021/jo01151a026

Reference yield:

2,4,4-trimethyl-2-pentanol (690-37-9) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → tert-butylbenzene (253185-03-4,253185-04-5) + (1,1,3,3-tetramethyl-butyl)-benzene (35293-37-9)

Guidance literature:

With aluminium trichloride; Petroleum ether; at -10 ℃;

DOI:10.1021/ja01870a019 DOI:10.1021/jo01202a009

upstream raw materials:

2-cyclohexyl-2,4,4-trimethyl-pentane

2-cyclohex-3-enyl-2,4,4-trimethyl-pentane

2,4,4-trimethyl-1-pentene

benzene

Downstream raw materials:

4,4-di-tert-octylphenylamine

tert-octylphenol

1-nitro-4-(1,1,3,3-tetramethyl-butyl)-benzene

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