triethylstannylium bromide

• ChemBase ID: 303851
• Molecular Formular: C6H15BrSn
• Molecular Mass: 285.7883
• Monoisotopic Mass: 285.93790648
• SMILES: CC[Sn+](CC)CC.[Br-]
• Canonical SMILES: CC[Sn+](CC)CC.[Br-]
• InChI: InChI=1S/3C2H5.BrH.Sn/c3*1-2;;/h3*1H2,2H3;1H;/q;;;;+1/p-1
• InChIKey: KQPIFPBKXYBDGV-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: triethylstannylium bromide
• IUPAC Traditional name: triethylstannylium bromide
• Synonyms: Bromotriethylstannane; Triethyltin bromide; 三乙基溴化锡

Database IDs

• CAS Number: 2767-54-6
• EC Number: 220-443-5
• MDL Number: MFCD00000052

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.934
• LogD (pH = 7.4): 0.934
• Log P: 0.934
• Molar Refractivity: 31.0407 cm^3
• Polarizability: 16.89129 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid
• Melting Point: -13.5°C
• Boiling Point: 223-225°C
• Flash Point: 99°C(210°F)
• Density: 1.63
• Refractive Index: 1.520

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Nature polluting (N); Highly toxic (T+)
• UN Number: UN2788
• Hazard Class: 6.1
• Packing Group: II
• Risk Statements: 26/27/28-50/53
• Safety Statements: 26-27/28-45-60-61
• TSCA Listed: 是
• GHS Pictograms: GHS06; GHS09
• GHS Hazard statements: H300-H310-H330-H400-H410
• GHS Precautionary statements: P260-P301+P310-P304+P340-P320-P330-P361-P405-P501A