diindium(3+) ion hydrate trisulfate

• ChemBase ID: 149879
• Molecular Formular: H2In2O13S3
• Molecular Mass: 535.83908
• Monoisotopic Mass: 535.67350912
• SMILES: O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[In+3].[In+3]
• Canonical SMILES: [O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].O.[In+3].[In+3]
• InChI: InChI=1S/2In.3H2O4S.H2O/c;;3*1-5(2,3)4;/h;;3*(H2,1,2,3,4);1H2/q2*+3;;;;/p-6
• InChIKey: XUVCWJBXGHOWID-UHFFFAOYSA-H

NAMES AND DATABASE IDS

Names

• IUPAC name: diindium(3+) ion hydrate trisulfate
• IUPAC Traditional name: diindium(3+) ion hydrate trisulfate
• Synonyms: Indium(III) sulfate hydrate; 硫酸铟(III) 水合物

Database IDs

• CAS Number: 304655-87-6
• EC Number: 236-689-1
• MDL Number: MFCD00149747
• PubChem SID: 24857359; 162244041
• PubChem CID: 16211847

CALCULATED PROPERTIES

• Acid pKa: -3.034349
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -5.569452
• LogD (pH = 7.4): -5.594027
• Log P: -0.841552
• Molar Refractivity: 11.5274 cm^3
• Polarizability: 6.037845 Å^3
• Polar Surface Area: 80.26 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: solid

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Purity: 99.99% trace metals basis
• Linear Formula: In2(SO4)3 · xH2O

DETAILS

Sigma Aldrich - 288721

Packaging
10, 50 g in glass bottle