2-(ethenyldimethylsilyl)pyridine

• ChemBase ID: 140832
• Molecular Formular: C9H13NSi
• Molecular Mass: 163.29172
• Monoisotopic Mass: 163.08172595
• SMILES: C[Si](C)(C=C)c1ccccn1
• Canonical SMILES: C=C[Si](c1ccccn1)(C)C
• InChI: InChI=1S/C9H13NSi/c1-4-11(2,3)9-7-5-6-8-10-9/h4-8H,1H2,2-3H3
• InChIKey: UAMVROIJEVLNFM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(ethenyldimethylsilyl)pyridine
• IUPAC Traditional name: 2-(ethenyldimethylsilyl)pyridine
• Synonyms: Dimethyl(2-pyridyl)vinylsilane; 2-(Dimethylvinylsilyl)pyridine; 二甲基(2-吡啶基)乙烯基硅烷; 2-(二甲基乙烯基硅)吡啶

Database IDs

• CAS Number: 321155-39-9
• MDL Number: MFCD06797092
• PubChem SID: 162235070; 24885675
• PubChem CID: 11344183

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 3.155437
• LogD (pH = 7.4): 3.303726
• Log P: 3.306
• Molar Refractivity: 44.2114 cm^3
• Polarizability: 19.507633 Å^3
• Polar Surface Area: 12.89 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Flash Point: 129.2 °F; 54 °C
• Density: 0.916 g/mL at 25 °C
• Refractive Index: n20/D 1.504

Safety Information

• European Hazard Symbols: Irritant (Xi)
• UN Number: 1993
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 3
• Risk Statements: 10-36/37/38
• Safety Statements: 26
• GHS Pictograms: GHS02; GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H226-H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1993 3/PG 3
• Storage Temperature: 2-8°C

Product Information

• Purity: 90%
• Empirical Formula (Hill Notation): C9H13NSi

DETAILS

Sigma Aldrich - 682047

Application
Participates in a variety of C-C and C-X bond-forming processes including carbomagnesiation and borylation.1
Packaging
1, 5 g in glass bottle