CAS 13663-23-5

1-(4-Nitrophenyl)azepane

Description:

1-(4-Nitrophenyl)azepane, with the CAS number 13663-23-5, is a chemical compound characterized by its azepane ring, which is a seven-membered saturated heterocyclic structure containing one nitrogen atom. The presence of a 4-nitrophenyl group indicates that a nitro group is attached to the para position of a phenyl ring, contributing to the compound's reactivity and potential applications in various chemical reactions. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its nitro group can participate in electrophilic aromatic substitution reactions, making it useful in synthetic organic chemistry. Additionally, the azepane structure can influence the compound's biological activity, potentially making it of interest in medicinal chemistry. Safety data should be consulted for handling, as nitro compounds can be hazardous. Overall, 1-(4-Nitrophenyl)azepane serves as a valuable building block in the synthesis of more complex organic molecules.

Formula: C₁₂H₁₆N₂O₂

InChI: InChI=1S/C12H16N2O2/c15-14(16)12-7-5-11(6-8-12)13-9-3-1-2-4-10-13/h5-8H,1-4,9-10H2

InChI key: InChIKey=WXAAQKMTSQDMII-UHFFFAOYSA-N

SMILES: N(=O)(=O)C1=CC=C(C=C1)N2CCCCCC2

Synonyms:

• 1-(4-Nitrophenyl)-perhydroazepin
• 1-(4-Nitrophenyl)Azepane
• 1H-Azepine, hexahydro-1-(4-nitrophenyl)-
• 1H-Azepine, hexahydro-1-(p-nitrophenyl)-
• Hexamethylenimine, 1-(p-nitrophenyl)-
• N-(4'-Nitrophenyl)hexamethylenimine
• Hexahydro-1-(4-nitrophenyl)-1H-azepine
• Hexahydro-1-(4-nitrophenyl)-1H-azepine

1-(4-Nitrophenyl)azepane

CAS: 13663-23-5

1-(4-Nitrophenyl)azepane

Purity: ≥95%

Molecular weight: 220.27g/mol

Ref: 54-OR1005732

1-(4-nitrophenyl)azepane

CAS: 13663-23-5

Formula: C₁₂H₁₆N₂O₂

Purity: 98%

Molecular weight: 220.272

Ref: 10-F428243

1-(4-Nitrophenyl)azepane

CAS: 13663-23-5

1-(4-Nitrophenyl)azepane is a potent fxa inhibitor. It inhibits the serine proteases, such as thrombin, and has been shown to have anticoagulant effects in animal models. 1-(4-Nitrophenyl)azepane interacts with the active site of serine protease and competes with the substrate for binding to coagulation proteins. This inhibition leads to a reduction in coagulation and an increase in bleeding time.

Formula: C₁₂H₁₆N₂O₂

Purity: Min. 95%

Molecular weight: 220.27 g/mol

Ref: 3D-NAA66323