Benzyl 4-[(2Z)-2-(1-butyl-5-cyano-4-methyl-2,6-dioxo-1,6-dihydro-3(2H)-pyridinylidene)hydrazino]benzoate
[CAS# 88731-51-5]

Identification

• Name: Benzyl 4-[(2Z)-2-(1-butyl-5-cyano-4-methyl-2,6-dioxo-1,6-dihydro-3(2H)-pyridinylidene)hydrazino]benzoate
• Synonyms: 4-((1-Butyl-5-cyano-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)benzoic acid, phenylmethyl ester
• Molecular Formula: C₂₅H₂₄N₄O₄
• Molecular Weight: 444.48
• CAS Registry Number: 88731-51-5
• SMILES: O=C(OCc1ccccc1)c2ccc(cc2)N/N=C3/C(=C(/C#N)C(=O)N(C3=O)CCCC)C
• InChI: 1S/C25H24N4O4/c1-3-4-14-29-23(30)21(15-26)17(2)22(24(29)31)28-27-20-12-10-19(11-13-20)25(32)33-16-18-8-6-5-7-9-18/h5-13,27H,3-4,14,16H2,1-2H3/b28-22-
• InChIKey: YCVZLPDMZAYMFV-SLMZUGIISA-N

Properties

• Density: 1.225g/cm³ (Cal.)
• Boiling point: 592.727°C at 760 mmHg (Cal.)
• Flash point: 312.27°C (Cal.)