2,4,6-Trihydroxy-3-Nitro-N-Octylbenzamide
[CAS# 126395-22-0]

Identification

• Name: 2,4,6-Trihydroxy-3-Nitro-N-Octylbenzamide
• Synonyms: 2,4,6-Trihydroxy-3-Nitro-N-Octyl-Benzamide; Benzamide, 2,4,6-Trihydroxy-3-Nitro-N-Octyl-; N-Octyl-3-Nitro-2,4,6-Trihydroxybenzamide
• Molecular Formula: C₁₅H₂₂N₂O₆
• Molecular Weight: 326.35
• CAS Registry Number: 126395-22-0
• SMILES: C1=C(C(=C(C(=C1O)[N+]([O-])=O)O)C(NCCCCCCCC)=O)O
• InChI: 1S/C15H22N2O6/c1-2-3-4-5-6-7-8-16-15(21)12-10(18)9-11(19)13(14(12)20)17(22)23/h9,18-20H,2-8H2,1H3,(H,16,21)
• InChIKey: GHKVBXWBMCWZKD-UHFFFAOYSA-N

Properties

• Density: 1.293g/cm³ (Cal.)
• Boiling point: 477.863°C at 760 mmHg (Cal.)
• Flash point: 242.803°C (Cal.)