CAS 100991-93-3

3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, hydrochloride (1:1), (2R,3S,4R)-

Description:

3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, hydrochloride (1:1), with the CAS number 100991-93-3, is a chemical compound characterized by its pyrrolidine ring structure, which is a five-membered nitrogen-containing heterocycle. This compound features hydroxymethyl and hydroxyl functional groups, contributing to its potential solubility in water and reactivity. The specific stereochemistry indicated by (2R,3S,4R) suggests that it has three chiral centers, which can influence its biological activity and interactions with other molecules. As a hydrochloride salt, it is typically more stable and easier to handle than its free base form. This compound may have applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to its structural features that could interact with biological targets. However, detailed information regarding its toxicity, pharmacokinetics, and specific applications may require further investigation in scientific literature.

Formula: C₅H₁₁NO₃·ClH

InChI: InChI=1S/C5H11NO3.ClH/c7-2-3-5(9)4(8)1-6-3;/h3-9H,1-2H2;1H/t3-,4-,5+;/m1./s1

InChI key: InChIKey=PZGVJCJRMKIVLJ-ZDQHTEEMSA-N

SMILES: C(O)[C@@H]1[C@H](O)[C@H](O)CN1.Cl

Synonyms:

• 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, hydrochloride, (2R,3S,4R)-
• 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, hydrochloride, [2R-(2α,3α,4α)]-
• 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-, hydrochloride (1:1), (2R,3S,4R)-