disulfanylidenemolybdenum

• ChemBase ID: 107682
• Molecular Formular: MoS2
• Molecular Mass: 160.09
• Monoisotopic Mass: 161.84955
• SMILES: S=[Mo]=S
• Canonical SMILES: S=[Mo]=S
• InChI: InChI=1S/Mo.2S
• InChIKey: CWQXQMHSOZUFJS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: disulfanylidenemolybdenum
• IUPAC Traditional name: molybdenum disulfide
• Synonyms: Molybdenum disulfide; Molybdenum(IV) sulfide; MOLYBDENUM DISULFIDE; Molybdenite; 二硫化钼; 硫化钼(IV)

Database IDs

• CAS Number: 1317-33-5
• EC Number: 215-263-9
• MDL Number: MFCD00003470
• PubChem SID: 162094857; 24854060; 24885986
• PubChem CID: 14823
• CHEBI ID: 30704
• Chemspider ID: 14138
• Wikipedia Title: Molybdenum_disulfide

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.7656
• LogD (pH = 7.4): 0.7656
• Log P: 0.7656
• Molar Refractivity: 18.8676 cm^3
• Polarizability: 12.019255 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; soluble in aqua regia
• Apperance: black solid; powder
• Melting Point: 1185 °C decomp.
• Density: 5.06 g/cm^3; 5.06 g/mL at 25 °C(lit.)

Safety Information

• RTECS: QA4697000
• German water hazard class: nwg
• EU Index: not listed
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H332
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Purity: 99%
• Particle Size: ~6 μm (max. 40 μm); <2 μm
• Empirical Formula (Hill Notation): MoS2

DETAILS

MP Biomedicals - 05204580

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 234842

Application
Hydrogenation and isomerization catalyst.
Packaging
100, 500 g in glass bottle

Sigma Aldrich - 69860

Packaging
100, 500 g in glass bottle