6-(alpha-Methylbenzyl)-2,4-Dinitrophenol
[CAS# 64047-74-1]

Identification

• Name: 6-(alpha-Methylbenzyl)-2,4-Dinitrophenol
• Synonyms: Ai3-19616; Phenol, 2,4-Dinitro-6-(1-Phenylethyl)-; Phenol, 2,4-Dinitro-6-(Alpha-Methylbenzyl)-
• Molecular Formula: C₁₄H₁₂N₂O₅
• Molecular Weight: 288.26
• CAS Registry Number: 64047-74-1
• SMILES: C1=C(C(=C([N+]([O-])=O)C=C1[N+]([O-])=O)O)C(C2=CC=CC=C2)C
• InChI: 1S/C14H12N2O5/c1-9(10-5-3-2-4-6-10)12-7-11(15(18)19)8-13(14(12)17)16(20)21/h2-9,17H,1H3
• InChIKey: DGTJUIOBQZQQSD-UHFFFAOYSA-N

Properties

• Density: 1.385g/cm³ (Cal.)
• Boiling point: 398.181°C at 760 mmHg (Cal.)
• Flash point: 163.864°C (Cal.)