dibutyl(chloro){[dibutyl(chloro)stannyl]oxy}stannane

• ChemBase ID: 145681
• Molecular Formular: C16H36Cl2OSn2
• Molecular Mass: 552.76444
• Monoisotopic Mass: 554.01870913
• SMILES: CCCC[Sn](CCCC)(O[Sn](CCCC)(CCCC)Cl)Cl
• Canonical SMILES: CCCC[Sn](O[Sn](CCCC)(CCCC)Cl)(CCCC)Cl
• InChI: InChI=1S/4C4H9.2ClH.O.2Sn/c4*1-3-4-2;;;;;/h4*1,3-4H2,2H3;2*1H;;;/q;;;;;;;2*+1/p-2
• InChIKey: MWFOVBOCPFXQMF-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: dibutyl(chloro){[dibutyl(chloro)stannyl]oxy}stannane
• IUPAC Traditional name: dibutyl(chloro){[dibutyl(chloro)stannyl]oxy}stannane
• Synonyms: Bis(dibutylchlorotin(IV)) oxide; 双(二丁基氯锡(IV))氧化物

Database IDs

• CAS Number: 10428-19-0
• EC Number: 233-904-0
• MDL Number: MFCD00074921
• PubChem SID: 162239885; 24859933
• PubChem CID: 16682755

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 2.935
• LogD (pH = 7.4): 2.935
• Log P: 2.935
• Molar Refractivity: 92.568 cm^3
• Polarizability: 45.619038 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 14
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 109-112 °C(lit.)

Safety Information

• RTECS: JN8735000
• European Hazard Symbols: Corrosive (C)
• UN Number: 1759
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 34
• Safety Statements: 26-27-28-36/37/39-45
• GHS Pictograms: GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314
• GHS Precautionary statements: P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 1759 8/PG 2

Product Information

• Purity: 98%
• Linear Formula: {[CH3(CH2)3]2Sn(Cl)}2O

DETAILS

Sigma Aldrich - 331090

Packaging
10 g in glass bottle