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CAS 1245606-68-1

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2-Naphthalenepropanoic acid, β-amino-, methyl ester, hydrochloride (1:1), (βS)-

Description:
2-Naphthalenepropanoic acid, β-amino-, methyl ester, hydrochloride (1:1), (βS)- is a chemical compound characterized by its structural features that include a naphthalene ring system and a β-amino acid moiety. This compound is typically a white to off-white solid, soluble in water due to the presence of the hydrochloride salt form, which enhances its solubility compared to the free base. The β-amino acid structure suggests potential biological activity, possibly influencing its interaction with biological systems, such as acting as a neurotransmitter or modulating receptor activity. The methyl ester group indicates that it may undergo hydrolysis to release the corresponding acid, which can further participate in various chemical reactions. The specific stereochemistry denoted by (βS)- indicates the spatial arrangement of atoms around the chiral center, which can significantly affect the compound's biological properties and reactivity. Overall, this compound's unique structure and properties make it of interest in medicinal chemistry and pharmacology.
Formula:C14H15NO2·ClH
InChI:InChI=1S/C14H15NO2.ClH/c1-17-14(16)9-13(15)12-7-6-10-4-2-3-5-11(10)8-12;/h2-8,13H,9,15H2,1H3;1H/t13-;/m0./s1
InChI key:InChIKey=AGWISLUXYMAHCL-ZOWNYOTGSA-N
SMILES:[C@@H](CC(OC)=O)(N)C1=CC2=C(C=C1)C=CC=C2.Cl
Synonyms:
  • 2-Naphthalenepropanoic acid, β-amino-, methyl ester, hydrochloride (1:1), (βS)-
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