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CAS 1279038-54-8

:

1-Pyrrolidinecarboxylic acid, 4-amino-2-(hydroxymethyl)-, phenylmethyl ester, hydrochloride (1:1), (2S,4S)-

Description:
1-Pyrrolidinecarboxylic acid, 4-amino-2-(hydroxymethyl)-, phenylmethyl ester, hydrochloride (1:1), (2S,4S)- is a chemical compound characterized by its specific stereochemistry and functional groups. It features a pyrrolidine ring, which is a five-membered nitrogen-containing heterocycle, and includes a carboxylic acid moiety that contributes to its acidic properties. The presence of an amino group enhances its potential for forming hydrogen bonds, which can influence its solubility and reactivity. The hydroxymethyl group adds to its polarity, while the phenylmethyl ester indicates the presence of an aromatic ring, which can affect the compound's stability and interaction with biological systems. As a hydrochloride salt, it is typically more soluble in water compared to its free base form, making it suitable for various applications, including pharmaceutical formulations. The specific stereochemistry (2S,4S) suggests that the compound has defined spatial arrangements, which can be crucial for its biological activity and interaction with receptors or enzymes. Overall, this compound's unique structure and properties make it of interest in medicinal chemistry and related fields.
Formula:C13H18N2O3·ClH
InChI:InChI=1S/C13H18N2O3.ClH/c14-11-6-12(8-16)15(7-11)13(17)18-9-10-4-2-1-3-5-10;/h1-5,11-12,16H,6-9,14H2;1H/t11-,12-;/m0./s1
InChI key:InChIKey=LCLNJVMWXFRKOG-FXMYHANSSA-N
SMILES:C(OCC1=CC=CC=C1)(=O)N2[C@H](CO)C[C@H](N)C2.Cl
Synonyms:
  • 1-Pyrrolidinecarboxylic acid, 4-amino-2-(hydroxymethyl)-, phenylmethyl ester, hydrochloride (1:1), (2S,4S)-
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