CAS 72436-51-2

2-(Phenylmethyl)cyclohexanamine

Description:

2-(Phenylmethyl)cyclohexanamine, also known by its CAS number 72436-51-2, is an organic compound characterized by a cyclohexane ring substituted with an amine group and a phenylmethyl group. This compound typically exhibits a colorless to pale yellow appearance and is soluble in organic solvents. Its structure features a cyclohexane backbone, which contributes to its rigidity and potential for stereoisomerism due to the presence of the amine group. The amine functionality can engage in hydrogen bonding, influencing its reactivity and interactions with other molecules. This compound may be of interest in medicinal chemistry due to its potential biological activity, particularly in the context of drug design and development. Additionally, its properties can be influenced by the presence of the phenylmethyl group, which can affect lipophilicity and overall pharmacokinetics. As with many amines, it may also exhibit basicity, allowing it to participate in various chemical reactions, including alkylation and acylation. Safety and handling precautions should be observed, as with all chemical substances.

Formula: C₁₃H₁₉N

InChI: InChI=1S/C13H19N/c14-13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10,14H2

InChI key: InChIKey=YOPIHDSNQOMRGC-UHFFFAOYSA-N

SMILES: C(C1C(N)CCCC1)C2=CC=CC=C2

Synonyms:

• 2-(Phenylmethyl)cyclohexanamine
• 2-Benzyl-cyclohexylamine
• 1-Amino-2-benzylcyclohexane
• 2-Benzylcyclohexan-1-amine
• Cyclohexanamine, 2-(phenylmethyl)-

2-Benzylcyclohexan-1-amine

CAS: 72436-51-2

2-Benzylcyclohexan-1-amine is an oxime, which is a class of organic compounds that are derived from an amine and are characterized by the presence of at least one nitrogen atom in their structures. It can be synthesized by deuteration of cyclohexanone with deuterium gas. The reaction mechanism for this process includes catalytic reduction, acetylation, pyrolytic elimination, and reductive amination. 2-Benzylcyclohexan-1-amine has been shown to have a spectrum similar to the postulated spectrum for the compound N-methylphenethylamine, which has been proposed as a possible neurotransmitter in humans.

Formula: C₁₃H₁₉N

Purity: Min. 95%

Molecular weight: 189.3 g/mol

Ref: 3D-XCA43651