1-BROMO-3-TERT-BUTYLBENZENE
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1-BROMO-3-TERT-BUTYLBENZENE
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CAS No:
3972-64-3
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Formula:
C10H13Br
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Chemical Name:
1-BROMO-3-TERT-BUTYLBENZENE
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Synonyms:
benzene,1-bromo-3-tert-butyl-;3-(tert-Butyl)bromobenzene99%;1-BROMO-3-TERT-BUTYLBENZENE98%;1-Bromo-3-(1,1-dimethylethyl)benzene;benzene,1-bromo-3-(1,1-dimethylethyl)-
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CAS No:
Safety Information
C: Corrosive;
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
1-BROMO-3-TERT-BUTYLBENZENE Use and Manufacturing
A small portion (200 mg) of this mixture was dissolved in 1 ml of methylene chloride and then treated with a solution of 200 mg of m-chloroperbenzoic acid in 4 ml of methylene chloride. The mixture was stirred at room temperature for 1 hour and the methylene chloride removed in-vacuo. The residue was dissolved in hexane and filtered through a short silica column and the filtrate concentrated in-vacuo to give pure title compound as a colorless oil. PMR (CDCl3): and 1.30 (9H, s), 7.25 (1H, m), 7.41 (2H, m), 7.65 (H, t, J~2.1 Hz).mg) of this mixture was dissolved in 1 ml of methylene chloride and then treated with a solution of 200 mg of m-chloroperbenzoic acid in 4 ml of methylene chloride. The mixture was stirred at room temperature for 1 hour and the methylene chloride removed in-vacuo. The residue was dissolved in hexane and filtered through a short silica column and the filtrate concentrated in-vacuo to give pure title compound as a colorless oil. PMR (CDCl3) and 1.30 (9H, s), 7.25 (1H, m), 7.41 (2H, m), 7.65 (H, t, J~2.1 Hz).
Computed Properties
Molecular Weight:213.11
XLogP3:4.3
Rotatable Bond Count:1
Exact Mass:212.02006
Monoisotopic Mass:212.02006
Heavy Atom Count:11
Complexity:123
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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