1-Bromo-4-nonylbenzene

Base Information

• Chemical Name: 1-Bromo-4-nonylbenzene
• CAS No.: 51554-94-0
• Molecular Formula: C15H23Br
• Molecular Weight: 283.25
• Hs Code.: 2903999090
• European Community (EC) Number: 678-012-6
• DSSTox Substance ID: DTXSID30504086
• Nikkaji Number: J534.023C
• Wikidata: Q82358336
• Mol file: 51554-94-0.mol

Synonyms:1-Bromo-4-nonylbenzene;1-Bromo-4-n-nonylbenzene;51554-94-0;4-Nonylbromobenzene;1 -bromo-4-nonylbenzene;SCHEMBL2831631;DTXSID30504086;LVCWOFRWEVUMNY-UHFFFAOYSA-N;MFCD00061116;AKOS015835695;BS-22700;B1596;FT-0714456;T70990

Chemical Property of 1-Bromo-4-nonylbenzene

Chemical Property:

• Vapor Pressure: 0.000327mmHg at 25°C
• Refractive Index: 1.509
• Boiling Point: 107°C/0.2mm
• Flash Point: 107°C/0.2mm
• PSA: 0.00000
• Density: 1.115
• LogP: 5.74220
• XLogP3: 6.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 8
• Exact Mass: 282.09831
• Heavy Atom Count: 16
• Complexity: 148

Purity/Quality:

98% ^*data from raw suppliers

1-Bromo-4-nonylbenzene ^*data from reagent suppliers

Safty Information:

• Statements: 36/38
• Safety Statements: 26-37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCC1=CC=C(C=C1)Br

Technology Process of 1-Bromo-4-nonylbenzene

There total 14 articles about 1-Bromo-4-nonylbenzene 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: 94.0%

1-Bromo-4-((E)-non-1-enyl)-benzene (76287-61-1) → 4-bromo-1-(1-nonyl)benzene (51554-94-0)

Guidance literature:

With hydrogen; platinum(IV) oxide; In ethanol;

Reference yield: 40.0%

1-(4-bromophenyl)nonan-1-one (126334-26-7) → 4-bromo-1-(1-nonyl)benzene (51554-94-0)

Guidance literature:

With potassium hydroxide; hydrazine hydrate; In diethylene glycol; 130 deg C, 2 h then 200 deg C, 2 h;

Reference yield:

[1-(4-bromo-phenyl)-nonyloxy]-trimethyl-silane → 4-bromo-1-(1-nonyl)benzene (51554-94-0)

Guidance literature:

With sodium tetrahydroborate; In dimethyl sulfoxide; at 20 ℃; for 12h;

DOI:10.1560/E7HT-FH7B-7651-3HCN

upstream raw materials:

1-Bromo-4-((E)-non-1-enyl)-benzene

1-(4-bromophenyl)nonan-1-one

n-nonylbenzene

octylmagnesium bromide

Downstream raw materials:

C₃₂H₄₈

Tris-(4-nonyl-phenyl)-phosphane

4-(n-nonyl)benzaldehyde

4-n-nonylbenzeneboronic acid pinacolate

Refernces

• 1、 Ongayi, Owendi,Vicente, M. Gra?a H.,Ghosh, Brahma,Fronczek, Frank R.,Smith, Kevin M.. "Bilitrienones from the chemical oxidation of dodecasubstituted porphyrins". experimental part. p. 63 - 67. Retrieved 2010/03/04.
• 2、 Horie,Takagi,Hasebe,Ozawa,Ohta. "Discotic liquid crystals of transition metal complexes, 31: Establishment of mesomorphism and thermochromism of bis[1,2-bis(4-n-alkoxyphenyl)ethane-1,2-dithiolene]nickel complexes". . p. 1063 - 1071. Retrieved 2007/10/03.