2-tert-Butylanthracene

Base Information

• Chemical Name: 2-tert-Butylanthracene
• CAS No.: 18801-00-8
• Molecular Formula: C18H18
• Molecular Weight: 234.341
• Hs Code.: 29029000
• European Community (EC) Number: 242-588-3
• DSSTox Substance ID: DTXSID9066419
• Nikkaji Number: J222.308B
• Wikidata: Q81993006
• Mol file: 18801-00-8.mol

Synonyms:2-tert-Butylanthracene;2-(tert-Butyl)anthracene;18801-00-8;Anthracene, 2-(1,1-dimethylethyl)-;EINECS 242-588-3;Anthracene,2-(1,1-dimethylethyl)-;2-tertbutylanthracene;2-(t-butyl)anthracene;2-(tert-Butyl)anthracene 98%;DTXSID9066419;2-(tert-Butyl)anthracene, 98%;MFCD00003581;AKOS015838099;AS-61792;B3541;CS-0320760;FT-0637752;T70479

Chemical Property of 2-tert-Butylanthracene

Chemical Property:

• Appearance/Colour: light yellow powder
• Vapor Pressure: 0.001mmHg at 25°C
• Melting Point: 146-148 °C(lit.)
• Refractive Index: 1.601
• Boiling Point: 376.4 °C at 760 mmHg
• Flash Point: 174.7 °C
• PSA: 0.00000
• Density: 1.044 g/cm³
• LogP: 5.29050
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 234.140850574
• Heavy Atom Count: 18
• Complexity: 285

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-tert-Butylanthracene >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1=CC2=CC3=CC=CC=C3C=C2C=C1

Technology Process of 2-tert-Butylanthracene

There total 9 articles about 2-tert-Butylanthracene 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: 51.0%

2-bromoanthracene (7321-27-9) + tert-butylmagnesium chloride (677-22-5) → 2-(t-butyl)anthracene (18801-00-8) + C18H18

Guidance literature:

With nickel chloride hydrate; at -10 ℃; for 0.5h;

DOI:10.1016/j.cclet.2018.12.027

Reference yield:

2-methyl-5-tert-butyldiphenylmethane (62262-26-4) → 2-(t-butyl)anthracene (18801-00-8)

Guidance literature:

With chromium oxide-aluminium oxide-manganese oxide catalyst; at 450 ℃;

Reference yield:

2-t-butyl-1,2-dihydroanthracene (62337-62-6) → 2-(t-butyl)anthracene (18801-00-8)

Guidance literature:

With o-tetrachloroquinone;

DOI:10.1021/jo00434a013

upstream raw materials:

anthracene

2,6-di-tert-butylanthracene

tert-butyl alcohol

2-t-butyl-1,2-dihydroanthracene

Downstream raw materials:

2-tert-butylanthraquinine

2,6-di-tert-butylanthracene-9,10(4aH,9aH)-dione

2-tert-butyl-9,10-bis(2-biphenyl)anthracene

2-tert-butyl-9,10-bis-(β-naphthyl)-anthracene

Refernces

• 1、 Wu, Zhenghan,Si, Tengda,Xu, Guangqing,Xu, Bin,Tang, Wenjun. "Ligand-free nickel-catalyzed Kumada couplings of aryl bromides with tert-butyl Grignard reagents". supporting information. p. 597 - 600. Retrieved 2019/01/05.