Nitroclofene
[CAS# 39224-48-1]

Identification

• Name: Nitroclofene
• Synonyms: 4-Chloro-2-[(3-Chloro-2-Hydroxy-5-Nitro-Phenyl)Methyl]-6-Nitro-Phenol; 4-Chloro-2-(3-Chloro-2-Hydroxy-5-Nitro-Benzyl)-6-Nitro-Phenol; 4,6'-Dichloro-4',6-Dinitro-2,2'-Methylenediphenol
• Molecular Formula: C₁₃H₈Cl₂N₂O₆
• Molecular Weight: 359.12
• CAS Registry Number: 39224-48-1
• SMILES: C1=C(Cl)C=C(C(=C1CC2=CC(=CC(=C2O)Cl)[N+](=O)[O-])O)[N+](=O)[O-]
• InChI: 1S/C13H8Cl2N2O6/c14-8-2-6(13(19)11(4-8)17(22)23)1-7-3-9(16(20)21)5-10(15)12(7)18/h2-5,18-19H,1H2
• InChIKey: DIRNVHCNISKNQF-UHFFFAOYSA-N

Properties

• Density: 1.684g/cm³ (Cal.)
• Boiling point: 514.666°C at 760 mmHg (Cal.)
• Flash point: 265.06°C (Cal.)