dilithium(1+) ion dioxomolybdenumbis(olate)

• ChemBase ID: 110513
• Molecular Formular: Li2MoO4
• Molecular Mass: 173.8396
• Monoisotopic Mass: 175.91707558
• SMILES: [Li+].[Li+].[O-][Mo](=O)(=O)[O-]
• Canonical SMILES: [O-][Mo](=O)(=O)[O-].[Li+].[Li+]
• InChI: InChI=1S/2Li.Mo.4O/q2*+1;;;;2*-1
• InChIKey: NMHMDUCCVHOJQI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dilithium(1+) ion dioxomolybdenumbis(olate)
• IUPAC Traditional name: diLithoTab molybdate; dilithium(1+) ion molybdate
• Synonyms: Lithium molybdate; Lithium molybdate; Lithium molybdenum oxide; LITHIUM MOLYBDATE; 钼酸锂

Database IDs

• CAS Number: 13568-40-6
• EC Number: 236-977-7
• MDL Number: MFCD00016178
• PubChem SID: 162096447; 24864965
• PubChem CID: 6093689
• Chemspider ID: 3346702
• Wikipedia Title: Lithium_molybdate

CALCULATED PROPERTIES

• Acid pKa: -2.30103
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -5.970884
• LogD (pH = 7.4): -6.2965326
• Log P: -1.7752
• Molar Refractivity: 5.7716 cm^3
• Polarizability: 7.7780766 Å^3
• Polar Surface Area: 80.26 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: very soluble in water
• Apperance: Powder; powder or crystals; white odorless powder; hygroscopic
• Melting Point: 705°C
• Density: 2.66; 2.66 g/cm^3, solid; 2.66 g/mL at 25 °C(lit.)

Safety Information

• Storage Warning: Hygroscopic
• European Hazard Symbols: Corrosive (C); Flammable (F); Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38; R:14/15-34
• Safety Statements: 26-36/37/39; 26-37-60; S:8-45
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• NFPA704:
  

  0

  3

  1
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338; P261-P305+P351+P338-P302+P352-P321-P405-P501A
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: 99.9% trace metals basis; 99+%
• Linear Formula: Li2MoO4

DETAILS

Sigma Aldrich - 400904

Application
Used in comparative property studies of battery systems.1
Packaging
250 g in glass bottle