molybdenum(4+) ion disulfanediide

• ChemBase ID: 302878
• Molecular Formular: MoS2
• Molecular Mass: 160.09
• Monoisotopic Mass: 161.84955
• SMILES: [SH2-2].[SH2-2].[Mo+4]
• Canonical SMILES: [SH2-2].[SH2-2].[Mo+4]
• InChI: InChI=1S/Mo.2S/q+4;2*-2
• InChIKey: CKHDFXHTVVOBGY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: molybdenum(4+) ion disulfanediide
• IUPAC Traditional name: molybdenum(4+) ion disulfanediide
• Synonyms: Molybdenum(IV) sulfide; Molybdenum glance; Molybdenite, naturally occurring mineral, grains, approximately 0.06-0.19in; 硫化钼(IV); 辉钼矿, 天然矿物, 晶粒, 大约 0.06-0.19in

Database IDs

• CAS Number: 1309-56-4; 1317-33-5
• EC Number: 215-172-4; 215-263-9
• MDL Number: MFCD00003470
• Merck Index: 146236

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

• Solubility: Insoluble in water and dilute acids; Soluble in sulfuric and nitric acid
• Apperance: -325 Mesh Powder; Powder
• Melting Point: 1185°C

Safety Information

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

Product Information

• Purity: 98%; 99% (metals basis)