Description

Ethyl 4-(((benzyl(4-(ethoxycarbonyl)phenyl)amino)methylene)amino)benzoate (CAS No. 586400-06-8) is a high-purity organic compound with the molecular formula C₂₆H₂₆N₂O₄. This specialized chemical features a unique molecular structure combining benzoate and formamidine functional groups, making it valuable for advanced synthetic applications. The compound is supplied as a solid with guaranteed purity levels suitable for research and development purposes. Its precise IUPAC name is ethyl 4-[(N-benzyl-4-ethoxycarbonylanilino)methylideneamino]benzoate, reflecting its complex aromatic architecture. Proper storage conditions (room temperature, dry environment) are recommended to maintain stability. Researchers should handle this material with appropriate PPE as with all laboratory chemicals.

Properties

• CAS Number: 586400-06-8
• Complexity: 601
• IUPAC Name: ethyl 4-[(N-benzyl-4-ethoxycarbonyl-anilino)methyleneamino]benzoate
• InChI: InChI=1S/C26H26N2O4/c1-3-31-25(29)21-10-14-23(15-11-21)27-19-28(18-20-8-6-5-7-9-20)24-16-12-22(13-17-24)26(30)32-4-2/h5-17,19H,3-4,18H2,1-2H3
• InChI Key: WHRPFDOAMQIPQF-UHFFFAOYSA-N
• Exact Mass: 430.18925731
• Molecular Formula: C26H26N2O4
• Molecular Weight: 430.5
• SMILES: CCOC(=O)C1=CC=C(C=C1)N=CN(CC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OCC
• Topological: 68.2
• Monoisotopic Mass: 430.18925731
• Synonyms: 586400-06-8, Ethyl 4-(((benzyl(4-(ethoxycarbonyl)phenyl)amino)methylene)amino)benzoate, N,N’-BIS(4-ETHOXYCARBONYLPHENYL)-N-BENZYLFORMAMIDINE, ethyl 4-[(N-benzyl-4-ethoxycarbonylanilino)methylideneamino]benzoate, Ethyl 4-(((benzyl(4-(ethoxycarbonyl)phenyl)-amino)methylene)amino)benzoate, UV Absorber NP3, DTXSID30693000, WHRPFDOAMQIPQF-UHFFFAOYSA-N, CS-0453994, G82890, Ethyl4-(((benzyl(4-(ethoxycarbonyl)phenyl)amino)methylene)amino)benzoate, Ethyl 4-[(E)-({benzyl[4-(ethoxycarbonyl)phenyl]amino}methylidene)amino]benzoate

Application

This compound serves as a key intermediate in organic synthesis, particularly for constructing complex heterocyclic systems. Researchers utilize it in the development of novel pharmaceutical compounds and specialty materials. The bifunctional nature of the molecule makes it valuable for creating molecular scaffolds with specific electronic properties. It may also find application in materials science for designing advanced polymers with tailored characteristics.

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