hydrogen hexafluorotrihydridotitaniumiumylium

• ChemBase ID: 97581
• Molecular Formular: F6Ti++
• Molecular Mass: 161.8574192
• Monoisotopic Mass: 161.93836562
• SMILES: [Ti+2](F)(F)(F)(F)(F)F
• Canonical SMILES: F[Ti+2](F)(F)(F)(F)F
• InChI: InChI=1S/6FH.Ti/h6*1H;/q;;;;;;+8/p-6
• InChIKey: OYELKCCVDVCOLP-UHFFFAOYSA-H

NAMES AND DATABASE IDS

Names

• IUPAC name: hydrogen hexafluorotrihydridotitaniumiumylium
• IUPAC Traditional name: hydrogen(.) hexafluorotrihydridotitaniumiumylium
• Synonyms: Hexafluorotitanic acid (60% solution)

Database IDs

• CAS Number: 17439-11-1
• MDL Number: MFCD00049647
• PubChem SID: 162084180
• PubChem CID: 0

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.077
• LogD (pH = 7.4): 1.077
• Log P: 1.077
• Molar Refractivity: 11.4078 cm^3
• Polarizability: 6.453896 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Corrosive