2,6-Dinitro-4-Trifluoromethylbenzenesulfonic Acid
[CAS# 54729-99-6]

Identification

• Name: 2,6-Dinitro-4-Trifluoromethylbenzenesulfonic Acid
• Synonyms: 2,6-Dinitro-4-Trifluoromethylbenzenesulfonate; 2,6-Dinitro-4-Trifluoromethylbenzenesulfonic Acid; 2,6-Dinitro-Tfmbsa
• Molecular Formula: C₇H₃F₃N₂O₇S
• Molecular Weight: 316.17
• CAS Registry Number: 54729-99-6
• SMILES: C1=C(C(=C(C=C1C(F)(F)F)[N+](=O)[O-])[S](=O)(=O)O)[N+](=O)[O-]
• InChI: 1S/C7H3F3N2O7S/c8-7(9,10)3-1-4(11(13)14)6(20(17,18)19)5(2-3)12(15)16/h1-2H,(H,17,18,19)
• InChIKey: IVFGXTYRSDHGSH-UHFFFAOYSA-N

Properties

• Density: 1.866g/cm³ (Cal.)