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CAS 51760-21-5

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1,3-Benzenedicarboxylic acid, 5-bromo-, 1,3-dimethyl ester

Description:
1,3-Benzenedicarboxylic acid, 5-bromo-, 1,3-dimethyl ester, commonly known as a brominated derivative of phthalic acid, is an organic compound characterized by its two carboxylate ester functional groups and a bromine substituent on the benzene ring. This compound typically appears as a crystalline solid and is soluble in organic solvents, reflecting its ester functionality. The presence of bromine enhances its reactivity, making it useful in various chemical syntheses and applications, including as an intermediate in the production of dyes, pharmaceuticals, and agrochemicals. Its molecular structure contributes to its potential as a building block in organic synthesis, particularly in the development of more complex molecules. Additionally, the dimethyl ester groups provide a degree of steric hindrance, influencing its reactivity and interactions with other chemical species. Safety data should be consulted, as brominated compounds can pose environmental and health risks. Overall, this compound exemplifies the diverse applications of brominated aromatic compounds in organic chemistry.
Formula:C10H9BrO4
InChI:InChI=1S/C10H9BrO4/c1-14-9(12)6-3-7(10(13)15-2)5-8(11)4-6/h3-5H,1-2H3
InChI key:InChIKey=QUJINGKSNJNXEB-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC(C(OC)=O)=CC(Br)=C1
Synonyms:
  • 1,3-Benzenedicarboxylic acid, 5-bromo-, 1,3-dimethyl ester
  • 1,3-Benzenedicarboxylic acid, 5-bromo-, dimethyl ester
  • 1,3-Dimethyl 5-bromobenzene-1,3-dicarboxylate
  • 5-Bromo-Isophthalic Acid Dimethyl Ester
  • 5-Bromoisophthalic acid dimethyl ester
  • Dimethyl 3-bromoisophthalate
  • Dimethyl 5-Bromobenzene-1,3-Dicarboxylate
  • Dimethyl 5-bromo-1,3-benzenedicarboxylate
  • Dimethyl 5-bromoisophthalate
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