1,4-diethenylbenzene; butyldiethylsilane; ethenylbenzene

• ChemBase ID: 138860
• Molecular Formular: C26H38Si
• Molecular Mass: 378.66542
• Monoisotopic Mass: 378.27427775
• SMILES: CCCC[SiH](CC)CC.C=Cc1ccccc1.C=Cc1ccc(cc1)C=C
• Canonical SMILES: C=Cc1ccccc1.C=Cc1ccc(cc1)C=C.CCCC[SiH](CC)CC
• InChI: InChI=1S/C10H10.C8H20Si.C8H8/c1-3-9-5-7-10(4-2)8-6-9;1-4-7-8-9(5-2)6-3;1-2-8-6-4-3-5-7-8/h3-8H,1-2H2;9H,4-8H2,1-3H3;2-7H,1H2
• InChIKey: IAYVJRSWROTJFI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,4-diethenylbenzene; butyldiethylsilane; ethenylbenzene
• IUPAC Traditional name: butyldiethylsilane; divinylbenzene; styrene
• Synonyms: PS-DES; Butyldiethylsilane, polymer-bound; 丁基二乙基硅烷，聚合物键合型

Database IDs

• MDL Number: MFCD01322930
• PubChem SID: 24872844; 162233111; 24874263
• PubChem CID: 16213623

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.44665
• LogD (pH = 7.4): 3.44665
• Log P: 3.44665
• Molar Refractivity: 45.4306 cm^3
• Polarizability: 17.497032 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: >300 °C

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Particle Size: 100-200 mesh
• Extent of Labeling: 0.6-1.0 mmol typical loading per g; 1.1-1.6 mmol/g loading
• Crosslinking: 1 % cross-linked

DETAILS

Sigma Aldrich - 522309

Packaging
1, 5 g in glass bottle