dimethyl(2-phenylethyl)silane

• ChemBase ID: 145238
• Molecular Formular: C10H16Si
• Molecular Mass: 164.31954
• Monoisotopic Mass: 164.10212704
• SMILES: C[SiH](C)CCc1ccccc1
• Canonical SMILES: C[SiH](CCc1ccccc1)C
• InChI: InChI=1S/C10H16Si/c1-11(2)9-8-10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3
• InChIKey: RNNGWAAYFGGBOL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dimethyl(2-phenylethyl)silane
• IUPAC Traditional name: dimethyl(2-phenylethyl)silane
• Synonyms: Dimethylphenethylsilane; 二甲基苯乙基硅烷

Database IDs

• CAS Number: 17873-13-1
• MDL Number: MFCD00799522
• PubChem SID: 24870385; 162239447
• PubChem CID: 23165000

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.3688
• LogD (pH = 7.4): 2.3688
• Log P: 2.3688
• Molar Refractivity: 46.8641 cm^3
• Polarizability: 20.598316 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 83 °C/11 mmHg(lit.)
• Flash Point: 158 °F; 70 °C
• Density: 0.869 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.494(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 16-26-36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Product Information

• Purity: 98%
• Linear Formula: C6H5CH2CH2SiH(CH3)2

DETAILS

Sigma Aldrich - 467146

Packaging
5 mL in glass bottle