yttrium(3+) ion hexahydrate trichloride

• ChemBase ID: 302790
• Molecular Formular: Cl3O6Y
• Molecular Mass: 291.26125
• Monoisotopic Mass: 289.78189376
• SMILES: O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Y+3]
• Canonical SMILES: O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Y+3]
• InChI: InChI=1S/3ClH.6H2O.Y/h3*1H;6*1H2;/q;;;;;;;;;+3/p-3
• InChIKey: IINACGXCEZNYTF-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: yttrium(3+) ion hexahydrate trichloride
• IUPAC Traditional name: yttrium(3+) ion hexahydrate trichloride
• Synonyms: Yttrium(III) chloride hydrate, REacton®; 水合氯化钇(III), REacton®

Database IDs

• CAS Number: 12741-05-8
• EC Number: 233-801-0
• MDL Number: MFCD00149941
• Merck Index: 1410107

CALCULATED PROPERTIES

• Acid pKa: 15.7
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.652
• LogD (pH = 7.4): -0.652
• Log P: -0.652
• Molar Refractivity: 3.7 cm^3
• Polarizability: 1.4714895 Å^3
• Polar Surface Area: 25.3 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Crystalline Aggregates; Wet Crystalline Aggregates
• Density: 2.18

Safety Information

• Storage Warning: Hygroscopic
• TSCA Listed: 是

Product Information

• Purity: 99.9% (REO); 99.99% (REO)