bis((methylsulfanyl)methane); dichloroplatinum

• ChemBase ID: 143387
• Molecular Formular: C4H12Cl2PtS2
• Molecular Mass: 390.25208
• Monoisotopic Mass: 388.94053874
• SMILES: CSC.CSC.Cl[Pt]Cl
• Canonical SMILES: CSC.CSC.Cl[Pt]Cl
• InChI: InChI=1S/2C2H6S.2ClH.Pt/c2*1-3-2;;;/h2*1-2H3;2*1H;/q;;;;+2/p-2
• InChIKey: OWJNVRJATFZAKN-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: bis((methylsulfanyl)methane); dichloroplatinum
• IUPAC Traditional name: bis(dimethyl sulfide); platinum(II) chloride
• Synonyms: Bis(dimethylsulfur)platinum(II) dichloride; Dichlorobis(dimethyl sulfide)platinum(II)

Database IDs

• CAS Number: 55449-91-7
• MDL Number: MFCD00799640
• PubChem SID: 162237607
• PubChem CID: 10916135

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.2235795
• LogD (pH = 7.4): 1.2235795
• Log P: 1.2235795
• Molar Refractivity: 18.8917 cm^3
• Polarizability: 7.4785047 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 160-162 °C

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 36/39
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338

Product Information

• Empirical Formula (Hill Notation): C4H12Cl2PtS2

DETAILS

Sigma Aldrich - 732575

Packaging
250 mg in glass bottle