Titanocene Bis(Trichloroacetate)
[CAS# 91408-54-7]

Identification

• Name: Titanocene Bis(Trichloroacetate)
• Synonyms: Cyclopenta-1,3-Diene; Titanium(+4) Cation; 2,2,2-Trichloroethanoate; Titanium, Bis(Eta5-2,4-Cyclopentadien-1-Yl)Bis(Trichloroacetato-O,O')-; Titanocene Bis(Trichloroacetate)
• Molecular Formula: C₁₄H₁₀Cl₆O₄Ti
• Molecular Weight: 502.85
• CAS Registry Number: 91408-54-7
• SMILES: [CH-]1C=CC=C1.[CH-]2C=CC=C2.O=C([O-])C(Cl)(Cl)Cl.O=C([O-])C(Cl)(Cl)Cl.[Ti+4]
• InChI: 1S/2C5H5.2C2HCl3O2.Ti/c2*1-2-4-5-3-1;2*3-2(4,5)1(6)7;/h2*1-5H;2*(H,6,7);/q2*-1;;;+4/p-2
• InChIKey: XVPXMMDROCOUIY-UHFFFAOYSA-L

Properties

• Boiling point: 196.5°C at 760 mmHg (Cal.)
• Flash point: 66.3°C (Cal.)