dilanthanum(3+) ion calcium tetrasulfanediide

• ChemBase ID: 303095
• Molecular Formular: CaLa2S4
• Molecular Mass: 446.149
• Monoisotopic Mass: 445.66358098
• SMILES: [SH2-2].[SH2-2].[SH2-2].[SH2-2].[Ca+2].[La+3].[La+3]
• Canonical SMILES: [SH2-2].[SH2-2].[SH2-2].[SH2-2].[Ca+2].[La+3].[La+3]
• InChI: InChI=1S/Ca.2La.4S/q+2;2*+3;4*-2
• InChIKey: ZZSKUXUYRKRFDG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dilanthanum(3+) ion calcium tetrasulfanediide
• IUPAC Traditional name: dilanthanum(3+) ion calcium tetrasulfanediide
• Synonyms: Calcium lanthanum sulfide; 硫化镧钙

Database IDs

• CAS Number: 12525-03-0
• EC Number: 235-689-9
• MDL Number: MFCD00061418

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): -0.06446023
• LogD (pH = 7.4): -0.7196984
• Log P: -0.0375
• Molar Refractivity: 5.7558 cm^3
• Polarizability: 3.055504 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Powder

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26-37-60
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305+P351+P338-P302+P352-P321-P405-P501A

Product Information

• Purity: 99.9% (REO)