tetralithium(1+) ion silicate

• ChemBase ID: 137774
• Molecular Formular: Li4O4Si
• Molecular Mass: 119.8471
• Monoisotopic Mass: 120.02060321
• SMILES: [Li+].[Li+].[Li+].[Li+].[O-][Si]([O-])([O-])[O-]
• Canonical SMILES: [O-][Si]([O-])([O-])[O-].[Li+].[Li+].[Li+].[Li+]
• InChI: InChI=1S/4Li.O4Si/c;;;;1-5(2,3)4/q4*+1;-4
• InChIKey: YTZVWGRNMGHDJE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetralithium(1+) ion silicate
• IUPAC Traditional name: tetralithium(1+) ion orthosilicate
• Synonyms: Lithium orthosilicate; Lithium silicate (ortho); 正硅酸锂

Database IDs

• CAS Number: 13453-84-4
• EC Number: 236-634-1
• MDL Number: MFCD00070422
• PubChem SID: 162232035
• PubChem CID: 9920381

CALCULATED PROPERTIES

• Acid pKa: 9.822076
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -2.6008205
• LogD (pH = 7.4): -2.6024313
• Log P: -2.6008
• Molar Refractivity: 5.7716 cm^3
• Polarizability: 5.5141354 Å^3
• Polar Surface Area: 92.24 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: -100 Mesh Powder
• Melting Point: 1255°C dec.
• Density: 2.326

Safety Information

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

Product Information

• Purity: 99.9% (metals basis)
• Linear Formula: Li4SiO4