2,4-Dinitro-6-Pentan-2-Yl-Phenol
[CAS# 4097-36-3]

Identification

• Name: 2,4-Dinitro-6-Pentan-2-Yl-Phenol
• Synonyms: 2-(1-Methylbutyl)-4,6-Dinitro-Phenol; 2-(1-Methylbutyl)-4,6-Dinitrophenol; 2,4-Dinitro-6-Pentan-2-Yl-Phenol
• Molecular Formula: C₁₁H₁₄N₂O₅
• Molecular Weight: 254.24
• CAS Registry Number: 4097-36-3
• SMILES: C1=C(C=C(C(=C1C(CCC)C)O)[N+]([O-])=O)[N+]([O-])=O
• InChI: 1S/C11H14N2O5/c1-3-4-7(2)9-5-8(12(15)16)6-10(11(9)14)13(17)18/h5-7,14H,3-4H2,1-2H3
• InChIKey: PSOZMUMWCXLRKX-UHFFFAOYSA-N

Properties

• Density: 1.306g/cm³ (Cal.)
• Boiling point: 333.242°C at 760 mmHg (Cal.)
• Flash point: 136.452°C (Cal.)