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CAS 215309-01-6

:

3-(4-Methylpiperazin-1-yl)benzoic acid

Description:
3-(4-Methylpiperazin-1-yl)benzoic acid is an organic compound characterized by its structure, which includes a benzoic acid moiety attached to a piperazine ring that has a methyl group at the 4-position. This compound typically appears as a white to off-white solid and is soluble in polar solvents such as water and methanol, owing to the presence of the carboxylic acid functional group. The piperazine ring contributes to its potential biological activity, making it of interest in medicinal chemistry, particularly in the development of pharmaceuticals. The compound may exhibit properties such as moderate to high melting points and stability under standard laboratory conditions. Its molecular structure allows for various interactions, including hydrogen bonding, which can influence its reactivity and solubility. Additionally, the presence of the piperazine moiety may enhance its ability to cross biological membranes, making it a candidate for drug development. As with many chemical substances, safety data should be consulted to understand its handling and potential hazards.
Formula:C12H16N2O2
InChI:InChI=1/C12H16N2O2/c1-13-5-7-14(8-6-13)11-4-2-3-10(9-11)12(15)16/h2-4,9H,5-8H2,1H3,(H,15,16)
InChI key:InChIKey=HALATUFUWLWCQV-UHFFFAOYSA-N
SMILES:C(O)(=O)C=1C=C(C=CC1)N2CCN(C)CC2
Synonyms:
  • 3-(4-Methyl-1-piperazinyl)benzoic acid
  • Benzoic acid, 3-(4-methyl-1-piperazinyl)-
  • 3-(4-Methylpiperazin-1-yl)benzoic acid
  • 3-(4-Methylpiperazin-1-yl)Benz
  • 1-(3-Carboxyphenyl)-4-methylpiperazine
  • AKOS BB-5295
  • 215309-01-6
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