tricadmium(2+) ion octahydrate trisulfate

• ChemBase ID: 103639
• Molecular Formular: Cd3H16O20S3
• Molecular Mass: 769.54304
• Monoisotopic Mass: 773.64977991
• SMILES: O.O.O.O.O.O.O.O.[Cd+2].[Cd+2].[Cd+2].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-]
• Canonical SMILES: [O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].O.O.O.O.O.O.O.O.[Cd+2].[Cd+2].[Cd+2]
• InChI: InChI=1S/3Cd.3H2O4S.8H2O/c;;;3*1-5(2,3)4;;;;;;;;/h;;;3*(H2,1,2,3,4);8*1H2/q3*+2;;;;;;;;;;;/p-6
• InChIKey: AGHQMAQBLOTWPQ-UHFFFAOYSA-H

NAMES AND DATABASE IDS

Names

• IUPAC name: tricadmium(2+) ion octahydrate trisulfate
• IUPAC Traditional name: tricadmium(2+) octahydrate trisulfate; tricadmium(2+) ion octahydrate trisulfate
• Synonyms: Cadmium sulfate octahydrate; Sulfuric acid cadmium salt hydrate; CADMIUM SULFATE, ACS; Cadmium sulfate 8/3-hydrate; Cadmium sulfate 8/3-hydrate; Cadmium sulfate hydrate; 硫酸镉 8/3水合物; 硫酸镉 8/3水合物; 硫酸镉 水合物

Database IDs

• CAS Number: 7790-84-3
• EC Number: 231-152-8; 233-331-6
• MDL Number: MFCD02253000
• PubChem SID: 24855460; 24847320; 162090411; 24852546
• PubChem CID: 16211218

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

Safety Information

• Storage Condition: Room Temperature (15-30°C)
• RTECS: EV2850000
• European Hazard Symbols: Nature polluting (N); Highly toxic (T+); Harmful (Xn)
• UN Number: 2570
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 3; III
• Australian Hazchem: 2X
• Risk Statements: 45-46-60-61-25-26-48/23/25-50/53; R:20/21/22-50/53
• Safety Statements: 53-45-60-61; S:60-61
• EU Classification: T5
• EU Hazard Identification Number: 6.1B
• Emergency Response Guidebook(ERG) Number: 154
• GHS Pictograms: GHS06; GHS08; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H301-H330-H340-H350-H360-H372-H410
• GHS Precautionary statements: P201-P260-P273-P284-P301 + P310-P310
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Faceshields, Gloves; dust mask type N95 (US), Eyeshields, Faceshields, Gloves, type P2 (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 2570 6.1/PG 3

Product Information

• Purity: ≥98%; ≥98% (complexometric); ≥99.0%; ≥99.0% (calc. based on CdSO4 · 8/3 H2O, KT); 98.0-102.0% (ACS specification)
• Grade: ACS; ACS reagent; puriss.; puriss. p.a.; REAGENT; SAJ super special grade
• Impurities: ≤0.005% insoluble matter in H2O; ≤0.005% insolubles
• Cation Traces: As: ≤2 mg/kg; As: ≤5 mg/kg; Ca: ≤0.005%; Ca: ≤50 mg/kg; Co: ≤5 mg/kg; Cr: ≤5 mg/kg; Cu: ≤0.002%; Cu: ≤5 mg/kg; Fe: ≤0.001%; Fe: ≤10 mg/kg; Fe: ≤5 mg/kg; K: ≤0.01%; K: ≤50 mg/kg; Mg: ≤5 mg/kg; Mn: ≤5 mg/kg; Na: ≤0.02%; Na: ≤50 mg/kg; Ni: ≤10 mg/kg; Pb: ≤0.003%; Pb: ≤20 mg/kg; Zn: ≤0.05%; Zn: ≤100 mg/kg; Zn: ≤50 mg/kg
• Antion Traces: chloride (Cl-): ≤0.001%; chloride (Cl-): ≤10 mg/kg; chloride (Cl-): ≤50 mg/kg; nitrate (NO3-): ≤100 mg/kg; nitrate and nitrite (as NO3-): ≤30 mg/kg; NO3- and NO2-: ≤0.003%
• Linear Formula: CdSO4 · 8/3H2O

DETAILS

MP Biomedicals - 02152508

8/3 Hydrate
ACS Reagent Grade
Assay 98.0-102.0%

Sigma Aldrich - 255513

Packaging
100 g in poly bottle
Application
Applied in the formation of novel two-dimensional Cd-SCN coordination solids with unusual and tailorable, checkerboard- or herringbone-patterned structures these structures are important steps toward technologically useful materials.1