antimony(3+) ion trimethanolate

• ChemBase ID: 303165
• Molecular Formular: C3H9O3Sb
• Molecular Mass: 214.86176
• Monoisotopic Mass: 213.95898415
• SMILES: C[O-].C[O-].C[O-].[Sb+3]
• Canonical SMILES: C[O-].C[O-].C[O-].[Sb+3]
• InChI: InChI=1S/3CH3O.Sb/c3*1-2;/h3*1H3;/q3*-1;+3
• InChIKey: KEUYHGXCOWNTEJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: antimony(3+) ion trimethanolate
• IUPAC Traditional name: antimony(3+) ion tris(methoxide)
• Synonyms: Antimony(III) methoxide; 甲氧基锑(III)

Database IDs

• CAS Number: 29671-18-9
• MDL Number: MFCD00014882

CALCULATED PROPERTIES

• Acid pKa: 15.775593
• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.51857704
• LogD (pH = 7.4): -0.5185771
• Log P: -0.51857704
• Molar Refractivity: 18.8116 cm^3
• Polarizability: 2.9253356 Å^3
• Polar Surface Area: 23.06 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Crystalline
• Melting Point: 124°C
• Flash Point: >110°C(230°F)

Safety Information

• Storage Warning: Air & Moisture Sensitive
• European Hazard Symbols: Flammable (F); Nature polluting (N); X
• UN Number: UN3181
• Hazard Class: 4.1
• Packing Group: III
• Risk Statements: 11-20/22-51/53
• Safety Statements: 16-61
• TSCA Listed: 否
• GHS Pictograms: GHS07; GHS09
• GHS Hazard statements: H302-H332-H411
• GHS Precautionary statements: P273

Product Information

• Purity: 95%; 99.5% (metals basis)