Description

Ethyl 2-bromoisovalerate (CAS No. 609-12-1) is a high-purity brominated ester compound with the molecular formula C₇H₁₃BrO₂. This specialized chemical, also known by its IUPAC name ethyl 2-bromo-3-methylbutanoate, is widely utilized in organic synthesis, pharmaceutical research, and as a key intermediate in the production of fine chemicals. Its unique brominated structure makes it valuable for nucleophilic substitution reactions and as a building block for more complex molecules. Our product is rigorously tested to ensure optimal purity and consistency, making it ideal for laboratory and industrial applications. Available in various quantities with detailed technical specifications, including GC/MS and NMR data upon request.

Properties

• CAS Number: 609-12-1
• Complexity: 112
• IUPAC Name: ethyl 2-bromo-3-methyl-butanoate
• InChI: InChI=1S/C7H13BrO2/c1-4-10-7(9)6(8)5(2)3/h5-6H,4H2,1-3H3
• InChI Key: WNFUWONOILPKNX-UHFFFAOYSA-N
• Exact Mass: 208.00989
• Molecular Formula: C7H13BrO2
• Molecular Weight: 209.08
• SMILES: CCOC(=O)C(C(C)C)Br
• Topological: 26.3
• Monoisotopic Mass: 208.00989
• Synonyms: Ethyl 2-bromoisovalerate, 609-12-1, Ethyl 2-bromo-3-methylbutanoate, Ethyl 2-bromo-3-methylbutyrate, Butanoic acid, 2-bromo-3-methyl-, ethyl ester, Ethyl .alpha.-bromoisovalerate, Ethyl alpha-bromoisovalerate, alpha-Bromoisovaleric acid ethyl ester, Butyric acid, 2-bromo-3-methyl-, ethyl ester, UNII-4J9877130M, NSC 8866, NSC-8866, EINECS 210-178-3, .alpha.-Bromoisovaleric acid ethyl ester, AI3-52374, 4J9877130M, DTXSID20870681, ETHYL 2-BROMOISOVALERATE [WHO-DD], 2-BROMO-3-METHYLBUTANOIC ACID ETHYL ESTER, DTXCID20818381, 210-178-3, inchi=1/c7h13bro2/c1-4-10-7(9)6(8)5(2)3/h5-6h,4h2,1-3h, wnfuwonoilpknx-uhfffaoysa-n, ethyl 2-bromo-3-methyl-butanoate, MFCD00026855, 2-bromo-3-methyl-butyric acid ethyl ester, 2-bromoisovaleric acid ethyl ester, Ethyl 2-Bromo Isovalerate, ethyl a-bromoisovalerate, ethyl-2-bromoisovalerate, 2-BROMOISOVALERIANIC ACID ETHYL ESTER, ethyl 2-bromoisopentanoate, SCHEMBL89146, Ethyl2-bromo-3-methylbutanoate, ethyl-2-bromo-3-methylbutyrate, NSC8866, ethyl-2-bromo-3-methyl-butanoate, SBB005789, STL452992, AKOS003625012, AKOS016842351, CS-W022654, FE22968, SB13077, 2-Bromo-3-methylbutyric Acid Ethyl Ester, BP-13193, DB-053738, Ethyl 2-bromo-3-methylbutyrate, AldrichCPR, E0969, NS00042769, EN300-40930, Q27259740, 2-Bromo-3-methylbutanoic acid ethyl ester;2-Bromo-3-methylbutyric acid ethyl ester;Ethyl 2-bromo-2-isopropylacetate

Application

Ethyl 2-bromoisovalerate serves as a versatile intermediate in organic synthesis, particularly in the preparation of branched-chain amino acid derivatives and pharmaceutical compounds. It is commonly employed in nucleophilic substitution reactions due to its reactive bromine moiety. Researchers also utilize this compound in the development of chiral catalysts and specialty polymers. Its stability and reactivity make it suitable for controlled radical polymerization processes.

Safety and Hazards

GHS Hazard Statements

• H302 (85.7%): Harmful if swallowed [Warning Acute toxicity, oral]
• H314 (93.9%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

Precautionary Statements

• P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501

Hazard Classes and Categories

• Acute Tox. 4 (85.7%)
• Skin Corr. 1B (93.9%)

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