CAS 2102412-61-1
:1,1-Dimethylethyl 2,2,4-tribromobutanoate
Description:
1,1-Dimethylethyl 2,2,4-tribromobutanoate, identified by its CAS number 2102412-61-1, is an organic compound characterized by its ester functional group. This substance features a branched alkyl group, specifically a tert-butyl group (1,1-dimethylethyl), which contributes to its steric hindrance and influences its reactivity and physical properties. The presence of three bromine atoms at the 2, 2, and 4 positions of the butanoate chain enhances its polarity and can affect its solubility in various solvents. The compound is likely to exhibit significant biological activity due to the bromine substituents, which can impact its interaction with biological systems. Additionally, the structure suggests potential applications in organic synthesis or as an intermediate in the production of other chemical compounds. However, specific data regarding its toxicity, stability, and reactivity would require further investigation through experimental studies or literature review. Overall, this compound exemplifies the complexity and diversity of organic chemistry, particularly in the context of halogenated esters.
Formula:C8H13Br3O2
InChI:InChI=1S/C8H13Br3O2/c1-7(2,3)13-6(12)8(10,11)4-5-9/h4-5H2,1-3H3
InChI key:InChIKey=BLCHLBAWYXXIMF-UHFFFAOYSA-N
SMILES:C(C(OC(C)(C)C)=O)(CCBr)(Br)Br
Synonyms:- 1,1-Dimethylethyl 2,2,4-tribromobutanoate
- Butanoic acid, 2,2,4-tribromo-, 1,1-dimethylethyl ester
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