trimethyl[3-(trimethylsilyl)phenyl]silane

• ChemBase ID: 303055
• Molecular Formular: C12H22Si2
• Molecular Mass: 222.47408
• Monoisotopic Mass: 222.12600377
• SMILES: C[Si](C)(C)c1cccc(c1)[Si](C)(C)C
• Canonical SMILES: C[Si](c1cccc(c1)[Si](C)(C)C)(C)C
• InChI: InChI=1S/C12H22Si2/c1-13(2,3)11-8-7-9-12(10-11)14(4,5)6/h7-10H,1-6H3
• InChIKey: RDDMOMIMRPHKSZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: trimethyl[3-(trimethylsilyl)phenyl]silane
• IUPAC Traditional name: trimethyl[3-(trimethylsilyl)phenyl]silane
• Synonyms: 1,3-Bis(trimethylsilyl)benzene; 1,3-二(三甲基甲硅烷基)苯

Database IDs

• CAS Number: 2060-89-1
• MDL Number: MFCD00015591

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 5.2158
• LogD (pH = 7.4): 5.2158
• Log P: 5.2158
• Molar Refractivity: 58.1852 cm^3
• Polarizability: 27.282776 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: Liquid
• Boiling Point: 120°C/25mm
• Flash Point: >60°C(140°F)
• Refractive Index: 1.482

Safety Information

• TSCA Listed: 否
• GHS Hazard statements: H227
• GHS Precautionary statements: P210-P280-P370+P378A-P403+P235-P501A