hexylsilane

• ChemBase ID: 152335
• Molecular Formular: C6H16Si
• Molecular Mass: 116.27674
• Monoisotopic Mass: 116.10212704
• SMILES: CCCCCC[SiH3]
• Canonical SMILES: CCCCCC[SiH3]
• InChI: InChI=1S/C6H16Si/c1-2-3-4-5-6-7/h2-6H2,1,7H3
• InChIKey: QGGUMTNPIYCTSF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: hexylsilane
• IUPAC Traditional name: hexylsilane
• Synonyms: Hexylsilane; 三叔丁基硅烷

Database IDs

• CAS Number: 1072-14-6
• EC Number: 214-001-0
• MDL Number: MFCD00027291
• Beilstein Number: 1731336
• PubChem SID: 162246480; 24877899
• PubChem CID: 6328653

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.2025
• LogD (pH = 7.4): 1.2025
• Log P: 1.2025
• Molar Refractivity: 31.0739 cm^3
• Polarizability: 14.732455 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Flash Point: 12 °C; 53.6 °F
• Density: 0.721 g/mL at 20 °C(lit.)
• Refractive Index: n20/D 1.414

Safety Information

• European Hazard Symbols: Flammable (F)
• UN Number: 1993
• German water hazard class: 1
• Hazard Class: 3
• Packing Group: 2
• Risk Statements: 11
• Safety Statements: 16-23-24/25
• GHS Pictograms: GHS02
• GHS Signal Word: Danger
• GHS Hazard statements: H225
• GHS Precautionary statements: P210
• 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 2

Product Information

• Purity: ≥97.0%
• Empirical Formula (Hill Notation): C6H16Si

DETAILS

Sigma Aldrich - 53262

Packaging
5 mL in glass bottle