trioctylsilane

• ChemBase ID: 149433
• Molecular Formular: C24H52Si
• Molecular Mass: 368.75518
• Monoisotopic Mass: 368.3838282
• SMILES: CCCCCCCC[SiH](CCCCCCCC)CCCCCCCC
• Canonical SMILES: CCCCCCCC[SiH](CCCCCCCC)CCCCCCCC
• InChI: InChI=1S/C24H52Si/c1-4-7-10-13-16-19-22-25(23-20-17-14-11-8-5-2)24-21-18-15-12-9-6-3/h25H,4-24H2,1-3H3
• InChIKey: JBAALNCKQCMFDH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: trioctylsilane
• IUPAC Traditional name: trioctylsilane
• Synonyms: Trioctylsilane; 三辛基硅烷

Database IDs

• CAS Number: 18765-09-8
• EC Number: 242-559-5
• MDL Number: MFCD00053812
• PubChem SID: 162243598; 24868441
• PubChem CID: 6327367

CALCULATED PROPERTIES

• Molar Refractivity: 114.4277 cm^3
• Polarizability: 47.976288 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 21
• Lipinski's Rule of Five: false
• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 8.5033
• LogD (pH = 7.4): 8.5033
• Log P: 8.5033

PROPERTIES

Physical Property

• Boiling Point: 163-165 °C/0.15 mmHg(lit.)
• Flash Point: 113 °C; 235.4 °F
• Density: 0.821 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.454(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319
• GHS Precautionary statements: P305 + P351 + P338

Product Information

• Purity: 95%
• Linear Formula: [CH3(CH2)7]3SiH

DETAILS

Sigma Aldrich - 448923

Other Notes
Contains various branched isomeric octylsilanes
Packaging
5, 25 mL in glass bottle