1284245-36-8 | 3-FluorocyclobutanaMine Hydrochloride

CAS:1284245-36-8 | 3-FluorocyclobutanaMine Hydrochloride,Description

“Cis-3-Fluorocyclobutanamine hydrochloride” is a chemical compound with the molecular formula C4H9ClFN. It has a molecular weight of 125.57 g/mol. The compound is also known by several other names, including “3-Fluorocyclobutanamine Hydrochloride” and “cis-3-Fluorocyclobutanamine hydrochloride 1284245-36-8” among others.

Molecular Structure Analysis

The InChI code for “cis-3-Fluorocyclobutanamine hydrochloride” is InChI=1S/C4H8FN.ClH/c5-3-1-4(6)2-3;/h3-4H,1-2,6H2;1H. Its canonical SMILES representation is C1C(CC1F)N.Cl.

Physical And Chemical Properties Analysis

“Cis-3-Fluorocyclobutanamine hydrochloride” is a solid at room temperature. It should be stored in a refrigerator.

Scientific Research Applications

Synthesis and Physicochemical Properties

cis-3-Fluorocyclobutanamine hydrochloride is a compound of significant interest in scientific research. The synthesis and physicochemical properties of related compounds, such as 3-Fluorocyclobutylamines, have been explored, revealing critical insights into their behavior and potential applications. A study by Chernykh et al. (2015) focused on synthesizing unknown cis- and trans-3-alkyl- and 3-aryl-3-fluorocycobutylamines from 3-oxocyclobutane carboxylic acid. They found that the fluorinated trans-compounds were more lipophilic compared to non-fluorinated analogs, while the difference was marginal for cis isomers. This indicates potential applications in areas where the interaction of fluorine and the amino function is of interest, with no through-space interactions noted in this particular case (Chernykh et al., 2015).

Stereoselective Synthesis

The stereoselective synthesis of related compounds like cis- and trans-3-fluoro-1-phenylcyclobutylamine has been developed, offering excellent stereoselectivity. This process involves the reduction of appropriately substituted cyclobutanone to yield cis- or trans-isomers of 3-hydroxyl-1-phenylcyclobutylamine, which are then converted to the 3-fluoro derivative. This method's high stereoselectivity makes it a valuable approach for producing specific isomers for further study or application (Shao & Ye, 2008).

Antitumor Activity

The introduction of fluoro, chloro, bromo, and hydroxy substituents into the cyclobutane ring has been explored to synthesize new carboplatin derivatives. Notably, the 3-fluoro, 3-chloro, and 3,3-difluoro derivatives of carboplatin exhibited superior antiproliferative activity in various cancer cell lines compared to the parent compound, carboplatin. This suggests a potential application of cis-3-Fluorocyclobutanamine hydrochloride or its derivatives in developing novel antitumor agents (Bernhardt et al., 2004).

Safety And Hazards

The compound is labeled with the GHS07 pictogram, indicating that it can cause harm. It may be harmful if swallowed and may cause serious eye irritation. It may also be harmful in contact with skin and may cause respiratory irritation.

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