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CAS 1131588-00-5

:

Benzoic acid, 4-amino-5-bromo-2-methyl-, methyl ester

Description:
Benzoic acid, 4-amino-5-bromo-2-methyl-, methyl ester, identified by CAS number 1131588-00-5, is an organic compound characterized by its aromatic structure, which includes a benzoic acid moiety modified by an amino group and a bromo substituent. This compound features a methyl ester functional group, which enhances its solubility in organic solvents. The presence of the amino group suggests potential for hydrogen bonding and reactivity in various chemical reactions, while the bromo substituent may impart unique electronic properties and influence the compound's reactivity. Typically, such compounds exhibit moderate to low toxicity, but specific safety data should be consulted for handling and usage. The compound may be of interest in pharmaceutical research, agrochemicals, or as an intermediate in organic synthesis due to its functional groups. Its physical properties, such as melting point, boiling point, and solubility, would depend on the specific molecular interactions and the presence of substituents, which can significantly affect its behavior in different environments.
Formula:C9H10BrNO2
InChI:InChI=1S/C9H10BrNO2/c1-5-3-8(11)7(10)4-6(5)9(12)13-2/h3-4H,11H2,1-2H3
InChI key:InChIKey=RGEYIEQKPUEEIA-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(C)C=C(N)C(Br)=C1
Synonyms:
  • Methyl 4-amino-5-bromo-2-methylbenzoate
  • Benzoic acid, 4-amino-5-bromo-2-methyl-, methyl ester
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