2-(trimethylsilyl)pyridine

• ChemBase ID: 77671
• Molecular Formular: C8H13NSi
• Molecular Mass: 151.28102
• Monoisotopic Mass: 151.08172595
• SMILES: n1c(cccc1)[Si](C)(C)C
• Canonical SMILES: C[Si](c1ccccn1)(C)C
• InChI: InChI=1S/C8H13NSi/c1-10(2,3)8-6-4-5-7-9-8/h4-7H,1-3H3
• InChIKey: IBLKFJNZUSUTPB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(trimethylsilyl)pyridine
• IUPAC Traditional name: 2-(trimethylsilyl)pyridine
• Synonyms: 2-(Trimethylsilyl)pyridine; 2-(Trimethylsilyl)pyridine; 2-三甲硅基吡啶; 2-(三甲基硅)吡啶

Database IDs

• CAS Number: 13737-04-7
• MDL Number: MFCD06797181
• PubChem SID: 24883906; 162042543; 24883715
• PubChem CID: 139573

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 2.8258755
• LogD (pH = 7.4): 3.0148444
• Log P: 3.0179
• Molar Refractivity: 40.2782 cm^3
• Polarizability: 17.897573 Å^3
• Polar Surface Area: 12.89 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 47-49 °C/5 mmHg(lit.); 47-49°C/5mm; 47-49°C/5mm
• Flash Point: 125.6 °F; 52 °C; 52°C; 52°C(126°F)
• Density: 0.911; 0.9113 g/mL at 25 °C(lit.)
• Refractive Index: 1.489; 1.4890; n20/D 1.489(lit.)

Safety Information

• Storage Warning: Irritant; Light Sensitive
• European Hazard Symbols: Irritant (Xi)
• UN Number: 1993; UN1993
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 3; III
• Risk Statements: 10-36/37/38
• Safety Statements: 16-26-36; 23-26-37
• TSCA Listed: 否
• GHS Pictograms: GHS02; GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H226-H315-H319-H335
• GHS Precautionary statements: P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A; 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

Product Information

• Purity: 97%; 98%
• Empirical Formula (Hill Notation): C8H13NSi

DETAILS

Sigma Aldrich - 649856

包装
1, 10 g in glass bottle

Sigma Aldrich - 652849

Packaging
1, 10 g in glass bottle