CAS 828934-43-6

2-Oxiranecarboxylic acid, 2-[6-(4-chlorophenoxy)hexyl]-, sodium salt (1:1), (2S)-

Description:

2-Oxiranecarboxylic acid, 2-[6-(4-chlorophenoxy)hexyl]-, sodium salt (1:1), (2S)-, is a chemical compound characterized by its unique structure that includes an epoxide group (oxirane) and a carboxylic acid functional group. The presence of the sodium salt indicates that the compound is likely soluble in water, which is a common trait for many salts. The compound features a hexyl chain substituted with a 4-chlorophenoxy group, contributing to its hydrophobic characteristics. This structure may impart specific biological activities or interactions, making it of interest in various applications, including pharmaceuticals or agrochemicals. The (2S)- designation indicates the specific stereochemistry of the compound, which can influence its reactivity and interaction with biological systems. Overall, this compound's properties, such as solubility, reactivity, and potential biological activity, are influenced by its functional groups and overall molecular architecture. Further studies would be necessary to fully elucidate its behavior in different environments and applications.

Formula: C₁₅H₁₉ClO₄·Na

InChI: InChI=1S/C15H19ClO4.Na/c16-12-5-7-13(8-6-12)19-10-4-2-1-3-9-15(11-20-15)14(17)18;/h5-8H,1-4,9-11H2,(H,17,18);/t15-;/m0./s1

InChI key: InChIKey=ZUMIFLJZQDMWAU-RSAXXLAASA-N

SMILES: C(CCCCCOC1=CC=C(Cl)C=C1)[C@@]2(C(O)=O)CO2.[Na]

Synonyms:

• Oxiranecarboxylic acid, 2-[6-(4-chlorophenoxy)hexyl]-, sodium salt, (2S)-
• 2-Oxiranecarboxylic acid, 2-[6-(4-chlorophenoxy)hexyl]-, sodium salt (1:1), (2S)-
• S-Etomxir
• (2S)-2-[6-(4-Chlorophenoxy)hexyl]oxiranecarboxylic acid sodium salt
• S-ETOMOXIR;(-)-ETOMOXIR