1-Bromo-3-(tert-butyl)-5-methylbenzene | CAS 193905-94-1

Element: methylbenzene bromo butyl tert

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C-S » Chemicals » bromo-tert-butyl-methylbenzene-PX37493

Identification

1-Bromo-3-(tert-butyl)-5-methylbenzene

CAS:

193905-94-1

EINECS:

Molecular Formula:

C₁₁H₁₅ Br

MDL:

MFCD09801037

SMILES:

Cc1cc(Br)cc(c1)C(C)(C)C

Synonym:

1-Bromo-3-(tert-butyl)-5-methylbenzene ; 3-Bromo-5-(tert-butyl)toluene ; Benzene,1-bromo-3-(1,1-dimethylethyl)-5-methyl-

Description

1-Bromo-3-(tert-butyl)-5-methylbenzene is a derivatized toluene compound that presents a useful aryl fragment for synthesis. The bromide functionality of 1-Bromo-3-(tert-butyl)-5-methylbenzene provides a location for carbon-carbon bond formation through cross-coupling protocols, allowing introduction of the tert-butyl methylbenzene moiety into structures.

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Properties for 1-Bromo-3-(tert-butyl)-5-methylbenzene

Molecular Weight:

227.14 g·mol−1

Density:

1.204 g/cm3

Boiling point:

231.5°C at 760 mmHg

Flash point:

91.4°C

Hazard Statements

GHS03
Harmful

Acute toxicity (oral, dermal, inhalation), category 4
Skin irritation, categories 2, 3
Eye irritation, category 2A
Skin sensitization, category 1
Specific target organ toxicity following single exposure, category 3
- Respiratory tract irritation
- Narcotic effects

Not used