Lot numbers can be found on the outside label of a product:
4-Bromo-2,6-di-tert-butylphenol
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CAS No. 1139-52-2
- Cat. No. CS-0154931
- Purity≥97%
- MDL No.MFCD00051598
*For research and further manufacturing use only, not for direct human use.
Structure of 1139-52-2
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General Information
- CAS No. 1139-52-2
- Cat. No. CS-0154931
- Purity ≥97%
- MDL No. MFCD00051598
- Storage RT, stored under nitrogen
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₄H₂₁BrO
- Molecular Weight 285.22
- Synonym(s) 2,6-Di-tert-butyl-4-bromophenol
- SMILES CC(C)(C)C1=C(C(=CC(=C1)Br)C(C)(C)C)O
Description
4-Bromo-2,6-di-tert-butylphenol is a 4-substituted-2,6-di-tert-butylphenol. It is synthesized by the bromination of 2,6-di-tert-butylphenol. The structure was confirmed by 1H NMR. Its photolysis reaction in benzene solution has been investigated. The photochemical reaction of 4-bromo-2,6-di-tert-butylphenol single crystals doped with 2,6-di-tert-butyl-p-quinone has been studied by EPR spectroscopy.4-Bromo-2,6-di-tert-butylphenol may be used in the following studies:As a terminating comonomer phenol in the phase transfer catalyzed (PTC) polymerization of 4-bromo-2,6-dimethylphenol.Synthesis of 1,1-[1,10-decanediylbis(oxy)]bis[(2,6-ditertbutyl-4-bromo)benzene], a monomer, which forms poly(p-phenylenevinylene) derivatives by reaction with 1,10-dibromodecane.As a reactant in the synthesis of 2,6-di-tert-butyl-phenolnorbornene (NArOH), a norbornene comonomer bearing an antioxidant hindered phenol.As a catalyst with methyl aluminium to form methylaluminum bis(4-bromo-2,6-di-tert-butylphenoxide) (MABR) which may be utilized for the transformation of various epoxides to carbonyl compounds.
Synthesis
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Route1
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128-39-2 - ~84%
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In-stock
1139-52-2
References
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Alinezhad, Heshmatollah; Tavakkoli, Sahar Mohseni; Salehian, Fatemeh Synthetic Communications, 2010 , vol. 40, # 21 p. 3226 - 3232
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Route2
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106-41-2
- ~%
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In-stock
1139-52-2
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In-stock
10323-39-4
References
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Journal of the American Chemical Society, , vol. 73, p. 3179,3181 US2459597 , ;
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References
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Journal of Organic Chemistry, , vol. 61, # 6 p. 2006 - 2012
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Safety Information
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GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H315-H319-H335
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Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 20.23
- LogP 4.7497
- H_Acceptors 1
- H_Donors 1
- Rotatable_Bonds 0
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Key Words
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