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209864

Sigma-Aldrich

4-tert-Butylaniline

99%

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Synonym(s):
4-(1,1-Dimethylethyl)aniline, 4-(1,1-Dimethylethyl)benzenamine, 4-Amino-tert-butylbenzene, 4-t-Butylphenylamine, 4-tert-Butylbenzenamine, 4-tert-Butylphenylamine, p-(tert-Butyl)phenylamine, p-tert-Butylaniline
Linear Formula:
(CH3)3CC6H4NH2
CAS Number:
Molecular Weight:
149.23
Beilstein/REAXYS Number:
2205786
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

99%

form

liquid

refractive index

n20/D 1.538 (lit.)

bp

90-93 °C/3 mmHg (lit.)

mp

15-16 °C (lit.)

density

0.937 g/mL at 25 °C (lit.)

SMILES string

CC(C)(C)c1ccc(N)cc1

InChI

1S/C10H15N/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7H,11H2,1-3H3

InChI key

WRDWWAVNELMWAM-UHFFFAOYSA-N

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General description

Schiff base formation reaction between 4-tert-butylaniline and 4-tert-butylbenzaldehyde in ethanol has been carried out using the matrix-assisted laser desorption ionization-chip system.

Application

4-tert-Butylaniline was used in the synthesis of:
  • 4-tert-Butyl-4′,4″-dinitrotriphenylamine, new triphenylamine-containing diamine monomer
  • 2-oxopyrimido[4,5-d]pyrimidin-5(6H)-one

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

wgk_germany

WGK 2

flash_point_f

closed cup

flash_point_c

closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter


Certificates of Analysis (COA)

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A novel and robust synthesis of the fragment, 2-amino-5-tert-butylpyridine, has been described, which has been shown to have improved physicochemical properties over 4-tert-butylaniline, when considering drug-like properties. The synthesis also yields fragments containing more highly oxidised precursors to the tert-butyl
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Marsh A, et al.
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Novel aromatic polyamides and polyimides functionalized with 4-tert-butyltriphenylamine groups.
Hsiao S-H, et al.
Journal of Polymer Science Part A: Polymer Chemistry, 44(15), 4579-4592 (2006)
Monica Brivio et al.
Lab on a chip, 5(4), 378-381 (2005-03-26)
The integration of a monitoring port along the microfluidic path of a MALDI-chip integrated device is described. Optimization of the microreactor design allows longer reaction and measuring times. The Schiff base reaction between 4-tert-butylaniline (1) and 4-tert-butylbenzaldehyde (2) in ethanol
Ji Han Kim et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 25(38), 9060-9070 (2019-04-16)
Organic light-emitting diodes are currently under research to achieve high efficiency and long life by using thermally activated delayed fluorescence (TADF) materials. In particular, many studies have focused on ensuring high efficiency in fluorescent devices by introducing TADF materials. Herein

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