2-[1-[2-[(4-Ethoxycarbonylpiperazin-1-Yl)(Thioxo)Methyl]Hydrazino]Ethyl]Pyridine 1-Oxide
[CAS# 87587-19-7]

Identification

• Name: 2-[1-[2-[(4-Ethoxycarbonylpiperazin-1-Yl)(Thioxo)Methyl]Hydrazino]Ethyl]Pyridine 1-Oxide
• Synonyms: 1-Piperazinecarboxylic acid, 4-(2-(1-(2-pyridyl)ethyl)thiocarbazoyl)-, ethyl ester, N'''-oxide; 4-{N'-[1-(1-Oxy-pyridin-2-yl)-ethyl]-hydrazinothiocarbonyl}-piperazine-1-carboxylic acid ethyl ester
• Molecular Formula: C₁₅H₂₃N₅O₃S
• Molecular Weight: 353.44
• CAS Registry Number: 87587-19-7
• SMILES: CCOC(=O)N1CCN(CC1)/C(=N/NC(C)C2=CC=CC=[N+]2[O-])/S
• InChI: 1S/C15H23N5O3S/c1-3-23-15(21)19-10-8-18(9-11-19)14(24)17-16-12(2)13-6-4-5-7-20(13)22/h4-7,12,16H,3,8-11H2,1-2H3,(H,17,24)
• InChIKey: XXCZYPXPGYHKCA-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 552.1±60.0°C at 760 mmHg (Cal.)
• Flash point: 287.7±32.9°C (Cal.)