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CAS 42854-62-6

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L-Alanine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)

Description:
L-Alanine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1), with the CAS number 42854-62-6, is a chemical compound that combines an amino acid derivative with a sulfonate group. This compound features L-alanine, an essential amino acid, which is known for its role in protein synthesis and metabolism. The phenylmethyl ester indicates that the carboxylic acid group of L-alanine is esterified with a phenylmethyl (benzyl) group, enhancing its lipophilicity and potentially influencing its biological activity. The presence of the 4-methylbenzenesulfonate moiety suggests that this compound may exhibit properties associated with sulfonate groups, such as increased solubility in water and potential applications in pharmaceuticals or biochemistry. The 1:1 ratio indicates a balanced stoichiometry between the alanine ester and the sulfonate, which may affect its reactivity and interactions in various chemical environments. Overall, this compound may be of interest in research related to drug development, biochemical assays, or as a building block in organic synthesis.
Formula:C10H13NO2·C7H8O3S
InChI:InChI=1S/C10H13NO2.C7H8O3S/c1-8(11)10(12)13-7-9-5-3-2-4-6-9;1-6-2-4-7(5-3-6)11(8,9)10/h2-6,8H,7,11H2,1H3;2-5H,1H3,(H,8,9,10)/t8-;/m0./s1
InChI key:InChIKey=NWOPHJSSBMABBD-QRPNPIFTSA-N
SMILES:C(OC([C@H](C)N)=O)C1=CC=CC=C1.S(=O)(=O)(O)C1=CC=C(C)C=C1
Synonyms:
  • (S)-Alanine benzyl ester p-toluenesulfonate
  • (S)-Alanine benzyl ester tosylate
  • (S)-Benzyl 2-aminopropanoate 4-methylbenzenesulfonate
  • <span class="text-smallcaps">L</span>-Alanine benzyl ester 4-toluenesulfonic acid salt
  • <span class="text-smallcaps">L</span>-Alanine benzyl ester p-toluenesulfonate
  • <span class="text-smallcaps">L</span>-Alanine benzyl ester p-toluenesulfonate salt
  • <span class="text-smallcaps">L</span>-Alanine benzyl ester p-toluenesulfonic acid salt
  • <span class="text-smallcaps">L</span>-Alanine benzyl ester tosylate
  • <span class="text-smallcaps">L</span>-Alanine, phenylmethyl ester, 4-methylbenzenesulfonate
  • <span class="text-smallcaps">L</span>-Alanine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)
  • See more synonyms
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