Description

Ethyl 4-[(N-methylanilino)methylideneamino]benzoate (CAS: 57834-33-0) is a high-purity organic compound with the molecular formula C₁₇H₁₈N₂O₂. This benzoate derivative features a unique N-methylanilino and methyleneamino functional group arrangement, making it a valuable intermediate in synthetic organic chemistry and materials science. With a molecular weight of 282.34 g/mol, this compound is supplied as a crystalline solid with >98% purity (HPLC), ensuring consistency for research and industrial applications. Its structure is ideal for studying Schiff base reactivity, coordination chemistry, and photophysical properties. Suitable for use in controlled environments, this product is packaged under inert conditions to guarantee stability and longevity.

Properties

• CAS Number: 57834-33-0
• Complexity: 343
• IUPAC Name: ethyl 4-[(N-methylanilino)methyleneamino]benzoate
• InChI: InChI=1S/C17H18N2O2/c1-3-21-17(20)14-9-11-15(12-10-14)18-13-19(2)16-7-5-4-6-8-16/h4-13H,3H2,1-2H3
• InChI Key: GNGYPJUKIKDJQT-UHFFFAOYSA-N
• Exact Mass: 282.136827821
• Molecular Formula: C17H18N2O2
• Molecular Weight: 282.34
• SMILES: CCOC(=O)C1=CC=C(C=C1)N=CN(C)C2=CC=CC=C2
• Topological: 41.9
• Monoisotopic Mass: 282.136827821
• Synonyms: 57834-33-0, Ethyl 4-[[(methylphenylamino)methylene]amino]benzoate, Benzoic acid, 4-[[(methylphenylamino)methylene]amino]-, ethyl ester, Ethyl 4-(((methylphenylamino)methylene)amino)benzoate, EINECS 260-976-0, DTXSID5069207, Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester, DTXCID7042273, Benzoic acid, 4-(methylphenylamino)methyleneamino-, ethyl ester, 260-976-0, Ethyl 4-(((methyl(phenyl)amino)methylene)amino)benzoate, UV-1, (E)-Ethyl 4-[[(Methylphenylamino)Methylene]Amino]Benzoate, N-(Ethoxycarbonylphenyl)-N’-Methyl-N’-Phenylformamidine, MFCD09263624, SCHEMBL454046, SCHEMBL536866, SCHEMBL809390, GNGYPJUKIKDJQT-UHFFFAOYSA-N, AKOS015895821, AKOS028108590, DS-9457, SB82075, FE147072, CS-0151758, NS00019908, D70762, Ethyl4-(((methyl(phenyl)amino)methylene)amino)benzoate

Application

This compound serves as a versatile building block in organic synthesis, particularly for constructing Schiff base ligands in coordination chemistry. Researchers utilize it in the development of photoactive materials due to its conjugated system, which may exhibit unique electronic properties. It is also explored in dye chemistry and as a potential precursor for pharmaceutical intermediates.

Safety and Hazards

GHS Hazard Statements

• H302 (45.2%): Harmful if swallowed [Warning Acute toxicity, oral]
• H373 (47.5%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]
• H411 (48.2%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

Precautionary Statements

• P260, P264, P270, P273, P301+P317, P319, P330, P391, and P501

Hazard Classes and Categories

• Acute Tox. 4 (45.2%)
• STOT RE 2 (47.5%)
• Aquatic Chronic 2 (48.2%)

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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.