titanium(3+) ion trichloride

• ChemBase ID: 303465
• Molecular Formular: Cl3Ti
• Molecular Mass: 154.226
• Monoisotopic Mass: 152.85450434
• SMILES: [Cl-].[Cl-].[Cl-].[Ti+3]
• Canonical SMILES: [Cl-].[Cl-].[Cl-].[Ti+3]
• InChI: InChI=1S/3ClH.Ti/h3*1H;/q;;;+3/p-3
• InChIKey: YONPGGFAJWQGJC-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: titanium(3+) ion trichloride
• IUPAC Traditional name: titanium(3+) ion trichloride
• Synonyms: Titanium(III) chloride; 三氯化钛(III)

Database IDs

• CAS Number: 7705-07-9
• EC Number: 231-728-9
• MDL Number: MFCD00011266
• Merck Index: 149481

CALCULATED PROPERTIES

• Acid pKa: -7.0
• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.8327582
• LogD (pH = 7.4): 0.8327582
• Log P: 0.6123387
• Molar Refractivity: 5.6156 cm^3
• Polarizability: 2.1090326 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid
• Density: 1.22

Safety Information

• Storage Warning: Air Sensitive
• European Hazard Symbols: Corrosive (C)
• UN Number: UN3264
• Hazard Class: 8
• Packing Group: II
• Risk Statements: 34
• Safety Statements: 26-36/37/39-45-60
• TSCA Listed: 是
• GHS Pictograms: GHS05
• GHS Hazard statements: H314
• GHS Precautionary statements: P260-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501A

Product Information

• Purity: 20% in 3% hydrochloric acid