1-[(3-Nitrophenyl)Methylideneamino]-3-Octadecyl-Thiourea
[CAS# 6299-31-6]

Identification

• Name: 1-[(3-Nitrophenyl)Methylideneamino]-3-Octadecyl-Thiourea
• Synonyms: 3-[(3-Nitrophenyl)Methyleneamino]-1-Octadecyl-Thiourea; 3-[(3-Nitrophenyl)Methyleneamino]-1-Octadecylthiourea; 3-[(3-Nitrobenzylidene)Amino]-1-Stearyl-Thiourea
• Molecular Formula: C₂₆H₄₄N₄O₂S
• Molecular Weight: 476.72
• CAS Registry Number: 6299-31-6
• SMILES: C1=CC=C(C=C1\C=N\NC(NCCCCCCCCCCCCCCCCCC)=S)[N+]([O-])=O
• InChI: 1S/C26H44N4O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-27-26(33)29-28-23-24-19-18-20-25(22-24)30(31)32/h18-20,22-23H,2-17,21H2,1H3,(H2,27,29,33)/b28-23+
• InChIKey: PCOKKNJGUXTQGU-WEMUOSSPSA-N

Properties

• Density: 1.06g/cm³ (Cal.)
• Boiling point: 574.433°C at 760 mmHg (Cal.)
• Flash point: 301.207°C (Cal.)