phenylstannanetris(ylium) trichloride

• ChemBase ID: 303857
• Molecular Formular: C6H5Cl3Sn
• Molecular Mass: 302.1639
• Monoisotopic Mass: 301.8478772
• SMILES: c1ccc(cc1)[Sn+3].[Cl-].[Cl-].[Cl-]
• Canonical SMILES: [Sn+3]c1ccccc1.[Cl-].[Cl-].[Cl-]
• InChI: InChI=1S/C6H5.3ClH.Sn/c1-2-4-6-5-3-1;;;;/h1-5H;3*1H;/q;;;;+3/p-3
• InChIKey: UBOGEXSQACVGEC-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: phenylstannanetris(ylium) trichloride
• IUPAC Traditional name: phenylstannanetris(ylium) trichloride
• Synonyms: Trichlorophenylstannane; Trichlorophenyltin; Phenyltin trichloride; 苯基三氯化锡

Database IDs

• CAS Number: 1124-19-2
• EC Number: 214-393-3
• MDL Number: MFCD00000513

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.1022
• LogD (pH = 7.4): 1.1022
• Log P: 1.1022
• Molar Refractivity: 25.4743 cm^3
• Polarizability: 14.7412 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid
• Density: 1.84

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Nature polluting (N); Toxic (T)
• UN Number: UN2788
• Hazard Class: 6.1
• Packing Group: III
• Risk Statements: 23/24/25-34-50/53
• Safety Statements: 4-9-20-26-27/28-36/37/39-45-57-60
• TSCA Listed: 否
• GHS Pictograms: GHS05; GHS06; GHS09
• GHS Hazard statements: H301-H311-H331-H314-H318-H400-H410
• GHS Precautionary statements: P260-P301+P310-P303+P361+P353-P305+P351+P338-P361-P405-P501A