cadmium(2+) ion hydrate sulfate

• ChemBase ID: 108805
• Molecular Formular: CdH2O5S
• Molecular Mass: 226.48888
• Monoisotopic Mass: 227.86565216
• SMILES: O.[Cd+2].[O-]S(=O)(=O)[O-]
• Canonical SMILES: [O-]S(=O)(=O)[O-].O.[Cd+2]
• InChI: InChI=1S/Cd.H2O4S.H2O/c;1-5(2,3)4;/h;(H2,1,2,3,4);1H2/q+2;;/p-2
• InChIKey: VRFRVKRTIMIRNG-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: cadmium(2+) ion hydrate sulfate
• IUPAC Traditional name: cadmium(2+) hydrate sulfate; cadmium(2+) ion hydrate sulfate
• Synonyms: CADMIUM SULFATE; Sulfuric acid cadmium salt hydrate; Cadmium sulfate hydrate; 硫酸镉 水合物

Database IDs

• CAS Number: 10124-36-4; 15244-35-6
• EC Number: 233-331-6
• MDL Number: MFCD00149629
• PubChem SID: 24852131; 162094465
• PubChem CID: 154912

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: true

PROPERTIES

Physical Property

• Apperance: powder and chunks

Safety Information

• RTECS: EV2700000
• European Hazard Symbols: Nature polluting (N); Toxic (T); Highly toxic (T+)
• UN Number: 2570
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 3
• Risk Statements: 45-46-60-61-25-26-48/23/25-50/53; R:22-48/23/25-49-50/53
• Safety Statements: 53-45-60-61; S:45-53-60-61
• 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: 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: 99.999% trace metals basis
• Linear Formula: CdSO4 · xH2O

DETAILS

Sigma Aldrich - 202924

Packaging
5 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