nickel(2+) ion hexahydrate diperchlorate

• ChemBase ID: 149918
• Molecular Formular: Cl2H12NiO14
• Molecular Mass: 365.68628
• Monoisotopic Mass: 363.89575332
• SMILES: O.O.O.O.O.O.[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[Ni+2]
• Canonical SMILES: [O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.O.O.O.O.O.O.[Ni+2]
• InChI: InChI=1S/2ClHO4.Ni.6H2O/c2*2-1(3,4)5;;;;;;;/h2*(H,2,3,4,5);;6*1H2/q;;+2;;;;;;/p-2
• InChIKey: WHGYCGOFTBFDLW-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: nickel(2+) ion hexahydrate diperchlorate
• IUPAC Traditional name: nickel(2+) ion hexahydrate diperchlorate
• Synonyms: Nickel(II) perchlorate hexahydrate; Nickel(II) perchlorate hexahydrate, Reagent Grade; 高氯酸镍(II) 六水合物; 高氯酸镍(II)六水合物, 试剂级

Database IDs

• CAS Number: 13520-61-1
• EC Number: 237-124-1
• MDL Number: MFCD00149804
• PubChem SID: 162244080; 24886378; 24858728
• PubChem CID: 15769463

CALCULATED PROPERTIES

• Acid pKa: -6.8919964
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -2.4740524
• LogD (pH = 7.4): -2.4740524
• Log P: -0.097653694
• Molar Refractivity: 11.9079 cm^3
• Polarizability: 5.355259 Å^3
• Polar Surface Area: 74.27 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Very soluble in water. Soluble in many organic solvents
• Apperance: crystalline; Damp crystalline solid
• Melting Point: 140 °C(lit.); 140°C
• Refractive Index: 1.55

Safety Information

• Storage Warning: Hygroscopic
• RTECS: SC9550000
• European Hazard Symbols: Nature polluting (N); Oxidising (O); Toxic (T)
• UN Number: 1481; UN1481
• German water hazard class: 3
• Hazard Class: 5.1
• Packing Group: 2; II
• Risk Statements: 49-61-34-42/43-48/23-68-50/53; 49-8-36/38-43
• Safety Statements: 53-16-26-36/37/39-45; 53-45-60-61
• TSCA Listed: 是
• GHS Pictograms: GHS03; GHS05; GHS08; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H272-H334-H350-H360-H372-H317-H341-H314-H318-H400-H410; H314-H317-H334-H341-H350i-H360D-H372-H410
• GHS Precautionary statements: P201-P261-P273-P280-P305 + P351 + P338-P310; P221-P210-P303+P361+P353-P305+P351+P338-P405-P501A
• Personal Protective Equipment: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P2 (EN 143) respirator cartridges, type P3 (EN 143) respirator cartridges; Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 1481 5.1/PG 2

Product Information

• Purity: ≥98.0% (KT)
• Grade: purum p.a.
• Cation Traces: Ca: ≤500 mg/kg; Cd: ≤50 mg/kg; Co: ≤500 mg/kg; Cu: ≤50 mg/kg; Fe: ≤50 mg/kg; K: ≤100 mg/kg; Na: ≤200 mg/kg; Pb: ≤50 mg/kg; Zn: ≤50 mg/kg
• Antion Traces: chloride (Cl-): ≤500 mg/kg; sulfate (SO42-): ≤500 mg/kg
• Quality: crystallized
• Linear Formula: Ni(ClO4)2 · 6H2O

DETAILS

Sigma Aldrich - 309338

Packaging
5, 100, 500 g in glass bottle
Application
Starting material for homometallic, trinuclear heteroscorpionate complexes applied in studies of electronic and magnetic properties.1