bis(dimethylstannanebis(ylium)) diacetate oxidandiide

• ChemBase ID: 303442
• Molecular Formular: C8H18O5Sn2
• Molecular Mass: 431.62752
• Monoisotopic Mass: 433.91981168
• SMILES: CC(=O)[O-].CC(=O)[O-].C[Sn+2]C.C[Sn+2]C.[O-2]
• Canonical SMILES: [O-]C(=O)C.[O-]C(=O)C.C[Sn+2]C.C[Sn+2]C.[O-2]
• InChI: InChI=1S/2C2H4O2.4CH3.O.2Sn/c2*1-2(3)4;;;;;;;/h2*1H3,(H,3,4);4*1H3;;;/q;;;;;;-2;2*+2/p-2
• InChIKey: VJBOWFBKQKSTBG-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: bis(dimethylstannanebis(ylium)) diacetate oxidandiide
• IUPAC Traditional name: bis(dimethylstannanebis(ylium)) diacetate oxidandiide
• Synonyms: Bis(acetoxydimethyltin)oxide; 双(醋酸二甲基锡)氧化物

Database IDs

• CAS Number: 5926-79-4
• EC Number: 227-660-4
• MDL Number: MFCD00070453

CALCULATED PROPERTIES

• Acid pKa: 4.54344
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -1.2242727
• LogD (pH = 7.4): -2.9968748
• Log P: -0.22334571
• Molar Refractivity: 23.4808 cm^3
• Polarizability: 4.912116 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Powder
• Melting Point: 240°C

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: X
• UN Number: UN3146
• Hazard Class: 6.1
• Packing Group: III
• Risk Statements: 20/21/22
• Safety Statements: 9-36/37
• TSCA Listed: 否
• GHS Pictograms: GHS06
• GHS Hazard statements: H331-H302-H312
• GHS Precautionary statements: P261-P280-P302+P352-P321-P405-P501A