trichlorosamarium hexahydrate

• ChemBase ID: 146098
• Molecular Formular: Cl3H12O6Sm
• Molecular Mass: 364.81068
• Monoisotopic Mass: 364.88967814
• SMILES: O.O.O.O.O.O.Cl[Sm](Cl)Cl
• Canonical SMILES: Cl[Sm](Cl)Cl.O.O.O.O.O.O
• InChI: InChI=1S/3ClH.6H2O.Sm/h3*1H;6*1H2;/q;;;;;;;;;+3/p-3
• InChIKey: TXVNDKHBDRURNU-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: trichlorosamarium hexahydrate
• IUPAC Traditional name: samarium(III) chloride hexahydrate
• Synonyms: Samarium trichloride hydrate; Samarium(III) chloride hexahydrate; 氯化钐(III) 六水合物

Database IDs

• CAS Number: 13465-55-9
• MDL Number: MFCD00149859
• PubChem SID: 24854950; 162240297; 24852248; 24888230
• PubChem CID: 16211489

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.9035
• LogD (pH = 7.4): 1.9035
• Log P: 1.9035
• Molar Refractivity: 18.4089 cm^3
• Polarizability: 13.283835 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: crystalline; powder and chunks
• Density: 2.383 g/mL at 25 °C(lit.)

Safety Information

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

Product Information

• Purity: ≥97.0% (AT); ≥99%; ≥99.99% trace metals basis
• Grade: purum
• Extent of Labeling: 41 Bq/g specific activity
• Linear Formula: SmCl3 · 6H2O

DETAILS

Sigma Aldrich - 248800

Packaging
10, 50 g in glass bottle

Sigma Aldrich - 204277

Packaging
5 g in poly bottle

Sigma Aldrich - 84440

Caution
radioactive
Other Notes
Sales restrictions may apply
Selective 1,2-reductions of conjugated ketones with sodium borohydride in the presence of samarium chloride