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Merck
CN

390992

Sigma-Aldrich

2,4,6-Tri-tert-butyl-N-methylaniline

95%

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About This Item

Linear Formula:
[(CH3)3C]3C6H2NHCH3
CAS Number:
Molecular Weight:
275.47
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay

95%

form

powder

mp

109-111 °C (lit.)

functional group

amine

SMILES string

CNc1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C

InChI

1S/C19H33N/c1-17(2,3)13-11-14(18(4,5)6)16(20-10)15(12-13)19(7,8)9/h11-12,20H,1-10H3

InChI key

GFTNLYGZUUPSSM-UHFFFAOYSA-N

General description

2,4,6-Tri-tert-butyl-N-methylaniline, a sterically hinderd amine, is an aniline derivative. The steric effect on charge-transfer (CT) band in its electronic spectra has been reported. The reactivity of 2,4,6-tri-tert-butyl-N-methylaniline with alkyl iodides under high pressure has been reported.

Application

2,4,6-Tri-tert-butyl-N-methylaniline may be used in the synthesis of 2,5-di-tert-butyl-N,N-dimethylanilinium iodide and 2,5-di-tert-butyl-N-ethyl-N-ethylanilinium iodide.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Suzuki H
Electronic absorption spectra and geometry of organic molecules: An application of molecular orbital theory (Elsevier), 485-485 (2012)
Steric hindrance under high pressure. Reactions of 2, 4, 6-tri-tert-butyl-N-methylaniline with alkyl iodides.
Okamoto Y and Shimizu H.
Journal of the American Chemical Society, 90(22), 6145-6148 (1968)

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