4-Tert-Butyl-2,6-Bis(1-Hydroxy-1-(Trifluoromethyl)-2,2,2-Trifluoroethyl)Iodobenzene
[CAS# 101697-28-3]

Identification

• Name: 4-Tert-Butyl-2,6-Bis(1-Hydroxy-1-(Trifluoromethyl)-2,2,2-Trifluoroethyl)Iodobenzene
• Synonyms: 2-[5-Tert-Butyl-2-Iodo-3-[2,2,2-Trifluoro-1-Hydroxy-1-(Trifluoromethyl)Ethyl]Phenyl]-1,1,1,3,3,3-Hexafluoro-Propan-2-Ol; 2-[5-Tert-Butyl-2-Iodo-3-[2,2,2-Trifluoro-1-Hydroxy-1-(Trifluoromethyl)Ethyl]Phenyl]-1,1,1,3,3,3-Hexafluoropropan-2-Ol; 2-[5-Tert-Butyl-3-(1,1,1,3,3,3-Hexafluoro-2-Hydroxy-Propan-2-Yl)-2-Iodo-Phenyl]-1,1,1,3,3,3-Hexafluoro-Propan-2-Ol
• Molecular Formula: C₁₆H₁₃F₁₂IO₂
• Molecular Weight: 592.16
• CAS Registry Number: 101697-28-3
• SMILES: C1=C(C(=C(C=C1C(C)(C)C)C(C(F)(F)F)(O)C(F)(F)F)I)C(C(F)(F)F)(O)C(F)(F)F
• InChI: 1S/C16H13F12IO2/c1-10(2,3)6-4-7(11(30,13(17,18)19)14(20,21)22)9(29)8(5-6)12(31,15(23,24)25)16(26,27)28/h4-5,30-31H,1-3H3
• InChIKey: OQSMDYOVGMLBFJ-UHFFFAOYSA-N

Properties

• Density: 1.746g/cm³ (Cal.)
• Boiling point: 376.719°C at 760 mmHg (Cal.)
• Flash point: 181.634°C (Cal.)