Skip to Content
MilliporeSigma
All Photos(1)

Documents

253928

Sigma-Aldrich

1-Bromo-4-tert-butylbenzene

97%

Sign Into View Organizational & Contract Pricing
All Photos(1)

About This Item

Linear Formula:
(CH3)3CC6H4Br
CAS Number:
3972-65-4
Molecular Weight:
213.11
Beilstein/REAXYS Number:
1859117
EC Number:
223-599-2
MDL number:
MFCD00000108
UNSPSC Code:
12352100
PubChem Substance ID:
24855340
NACRES:
NA.22

assay

97%

form

liquid

refractive index

n20/D 1.533 (lit.)

bp

80-81 °C/2 mmHg (lit.)

mp

13-16 °C (lit.)

density

1.229 g/mL at 25 °C (lit.)

SMILES string

CC(C)(C)c1ccc(Br)cc1

InChI

1S/C10H13Br/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7H,1-3H3

InChI key

XHCAGOVGSDHHNP-UHFFFAOYSA-N

Looking for similar products? Visit Product Comparison Guide

Related Categories

General description

1-Bromo-4-tert-butylbenzene undergoes lithium-bromide exchange reactions with n-butyllithium and tert-butyllithium at 0°C in various solvents.

Application

1-Bromo-4-tert-butylbenzene was used in the synthesis of 4-tert-butyl-phenylboronic acid, 1-deoxy analogs of CP-47,497 (n = 0 to 7) and 1-deoxy analogs of CP-55,940 (n = 0 to 7).

pictograms

Exclamation mark
GHS07

signalword

Warning

hcodes

H315,H319

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2

Storage Class

10 - Combustible liquids

wgk_germany

WGK 3

flash_point_f

206.6 °F

flash_point_c

97 °C

ppe

Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Novel non-symmetric nickel-diimine complexes for the homopolymerization of ethene: Control of branching by catalyst design.
Schmid M, et al.
Zeitschrift fur Naturforschung, B: Chemical Sciences, 57(10), 1141-1146 (2002)
William F Bailey et al.
The Journal of organic chemistry, 71(7), 2825-2828 (2006-03-25)
The outcome of reactions of 1-bromo-4-tert-butylbenzene (1), a representative aryl bromide, with n-BuLi or t-BuLi at 0 degrees C in a variety of solvent systems has been investigated. The products of reactions of 1 with n-BuLi vary significantly with changes
John W Huffman et al.
Bioorganic & medicinal chemistry, 16(1), 322-335 (2007-10-09)
A series of 1-deoxy analogs of CP-47,497 (8 and 13, n=0-7) and 1-deoxy analogs of CP-55,940 (9, n=0-7) have been synthesized and their affinities for the cannabinoid CB(1) and CB(2) receptors have been determined. Although the majority of these compounds
Xiao Yan et al.
Physical chemistry chemical physics : PCCP, 22(11), 6222-6230 (2020-03-05)
Unveiling the reaction mechanism is significant for developing high-performance catalysts. In this paper, a series of precisely controlled PdxM147-x (M = Cu, Pt, Au, Rh, Ru) dendrimer encapsulated nanoparticles (DENs) has been successfully synthesized. The mechanisms of PdxM147-x as catalysts

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service