dibutylstannanebis(ylium) sulfanediide

• ChemBase ID: 303447
• Molecular Formular: C8H20SSn
• Molecular Mass: 267.0104
• Monoisotopic Mass: 268.03076564
• SMILES: CCCC[Sn+2]CCCC.[SH2-2]
• Canonical SMILES: CCCC[Sn+2]CCCC.[SH2-2]
• InChI: InChI=1S/2C4H9.S.Sn/c2*1-3-4-2;;/h2*1,3-4H2,2H3;;/q;;-2;+2
• InChIKey: YFJZUAWAJPDEOK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dibutylstannanebis(ylium) sulfanediide
• IUPAC Traditional name: dibutylstannanebis(ylium) sulfanediide
• Synonyms: Di-n-butyltin sulfide; 二正丁基硫化锡

Database IDs

• CAS Number: 4253-22-9
• EC Number: 224-220-3
• MDL Number: MFCD00015528

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.1858
• LogD (pH = 7.4): 2.1858
• Log P: 2.1858
• Molar Refractivity: 38.9438 cm^3
• Polarizability: 20.164452 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid

Safety Information

• European Hazard Symbols: Toxic (T)
• UN Number: UN2788
• Hazard Class: 6.1
• Packing Group: III
• Risk Statements: 23/24/25
• Safety Statements: 4-9-20-27-36/37/39-45-60
• TSCA Listed: 是
• GHS Pictograms: GHS06
• GHS Hazard statements: H301-H311-H331
• GHS Precautionary statements: P261-P301+P310-P361-P302+P352-P405-P501A