tungsten(5+) ion triethanolate dichloride

• ChemBase ID: 303304
• Molecular Formular: C6H15Cl2O3W
• Molecular Mass: 389.9275
• Monoisotopic Mass: 388.9907557
• SMILES: CC[O-].CC[O-].CC[O-].[Cl-].[Cl-].[W+5]
• Canonical SMILES: [O-]CC.[O-]CC.[O-]CC.[Cl-].[Cl-].[W+5]
• InChI: InChI=1S/3C2H5O.2ClH.W/c3*1-2-3;;;/h3*2H2,1H3;2*1H;/q3*-1;;;+5/p-2
• InChIKey: VPFKRPRAHSGGPG-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: tungsten(5+) ion triethanolate dichloride
• IUPAC Traditional name: tungsten(5+) ion tris(ethoxide) dichloride
• Synonyms: Tungsten(V) dichloride triethoxide; 二氯化三乙氧基钨(V)

Database IDs

• CAS Number: 45000-93-9
• MDL Number: MFCD00210651

CALCULATED PROPERTIES

• Acid pKa: 16.470615
• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.1617691
• LogD (pH = 7.4): -0.1617691
• Log P: -0.1617691
• Molar Refractivity: 23.5602 cm^3
• Polarizability: 4.748913 Å^3
• Polar Surface Area: 23.06 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Corrosive (C); Flammable (F)
• UN Number: UN2924
• Hazard Class: 3
• Packing Group: II
• Risk Statements: 11-34
• Safety Statements: 16-26-36/37/39-45
• TSCA Listed: 否
• GHS Pictograms: GHS02; GHS05
• GHS Hazard statements: H225-H314-H318
• GHS Precautionary statements: P210-P280-P303+P361+P353-P305+P351+P338-P310

Product Information

• Purity: 10% w/v in ethanol