trimethyl(4-methylphenyl)silane

• ChemBase ID: 295468
• Molecular Formular: C10H16Si
• Molecular Mass: 164.31954
• Monoisotopic Mass: 164.10212704
• SMILES: Cc1ccc(cc1)[Si](C)(C)C
• Canonical SMILES: Cc1ccc(cc1)[Si](C)(C)C
• InChI: InChI=1S/C10H16Si/c1-9-5-7-10(8-6-9)11(2,3)4/h5-8H,1-4H3
• InChIKey: QGHURGPPCGMAMZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: trimethyl(4-methylphenyl)silane
• IUPAC Traditional name: trimethyl(4-methylphenyl)silane
• Synonyms: 4-(Trimethylsilyl)toluene; Trimethyl-p-tolylsilane; 三甲基间甲苯硅烷

Database IDs

• CAS Number: 3728-43-6
• MDL Number: MFCD00014850
• PubChem SID: 180680999
• PubChem CID: 298149

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 4.0984
• LogD (pH = 7.4): 4.0984
• Log P: 4.0984
• Molar Refractivity: 47.1628 cm^3
• Polarizability: 20.599329 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 191-192°C
• Flash Point: 46°C(115°F)
• Density: 0.865
• Refractive Index: 1.4910

Safety Information

• European Hazard Symbols: Irritant (Xi)
• UN Number: UN1993
• Hazard Class: 3
• Packing Group: III
• Risk Statements: 10-36/38
• Safety Statements: 26-37
• TSCA Listed: 否
• GHS Pictograms: GHS02; GHS07
• GHS Hazard statements: H226-H315-H319
• GHS Precautionary statements: P280G-P305+P351+P338

Product Information

• Purity: 97%