ChemicalBook Product Catalog Organic Chemistry Amides Naphthenic amines derivatives 2-tert-Butylaniline

2-tert-Butylaniline

Product Name2-tert-Butylaniline
CAS6310-21-0
MFC10H15N
MW149.23
EINECS228-634-5
MOL File6310-21-0.mol

Chemical Properties

Melting point	-60 °C (lit.)
Boiling point	123-124 °C/17 mmHg (lit.)
Density	0.957 g/mL at 25 °C (lit.)
refractive index	n20/D 1.545(lit.)
Flash point	216 °F
storage temp.	Keep in dark place,Sealed in dry,Room Temperature
solubility	Chloroform (Slightly), Methanol (Slightly)
pka	3.78±0.10(Predicted)
form	Liquid
color	Clear pale yellow to red-brown
InChI	InChI=1S/C10H15N/c1-10(2,3)8-6-4-5-7-9(8)11/h4-7H,11H2,1-3H3
InChIKey	AEIOZWYBDBVCGW-UHFFFAOYSA-N
SMILES	C1(N)=CC=CC=C1C(C)(C)C
CAS DataBase Reference	6310-21-0(CAS DataBase Reference)
NIST Chemistry Reference	Benzenamine, 2-(1,1-dimethylethyl)-(6310-21-0)

Safety Information

Hazard Codes	Xi,Xn
Risk Statements	36/37/38-20/21/22
Safety Statements	26-37/39-36/37/39
WGK Germany	3
HS Code	29214990
Storage Class	10 - Combustible liquids
Hazard Classifications	Eye Irrit. 2 Skin Irrit. 2 STOT SE 3

MSDS

Provider	Language
ACROS	English
SigmaAldrich	English

Usage And Synthesis

Chemical Properties

clear pale yellow to red-brown liquid

Uses

2-tert-Butylaniline may be used in the preparation of 2,3-bis(2-tert-butyl-phenyl-imino)butane. It may be used in the preparation of two rotamers, anti- and syn-N,N′-bis-(2-tert-butylphenyl)naphthalene-1,4,5,8-tetracarboxylic diimides and their guest inclusion abilities were investigated.

General Description

2-tert-Butylaniline is a sterically hindered aniline. 2-tert-Butylaniline participates in chemo- and regioselective copper-catalyzed cross-coupling reaction for the effective amination of 2-chlorobenzoic acids.

Synthesis

1634-04-4

62-53-3

6310-21-0

1. Aniline (1118 g, 0.012 mol), methyl tert-butyl ether (0.48 mol) and commercially available montmorillonite (3.83 g) were weighed into a 100 mL autoclave. 2. The autoclave was subjected to five successive displacements using nitrogen to ensure an oxygen-free reaction environment. 3. The reaction mixture was heated to 165 °C and mechanical stirring was initiated at a set stirring speed of 900 rpm. 4. Keep the reaction temperature within ±1°C of the set value for 4 hours. 5. Upon completion of the reaction, turn off the heating and stirring and allow the reaction mixture to cool naturally to room temperature. 6. remove the catalyst by centrifugation. 7. 7. Finally, the product was purified by distillation and chromatography to give O-tert-butylaniline with 98% purity.

References

[1] Patent: CN105218381, 2016, A. Location in patent: Paragraph 0012; 0013; 0014

2-tert-Butylaniline

Chemical Properties

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MSDS

Usage And Synthesis

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