diethoxydiethylsilane

• ChemBase ID: 156649
• Molecular Formular: C8H20O2Si
• Molecular Mass: 176.3287
• Monoisotopic Mass: 176.12325641
• SMILES: CCO[Si](CC)(CC)OCC
• Canonical SMILES: CC[Si](OCC)(OCC)CC
• InChI: InChI=1S/C8H20O2Si/c1-5-9-11(7-3,8-4)10-6-2/h5-8H2,1-4H3
• InChIKey: ZMAPKOCENOWQRE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: diethoxydiethylsilane
• IUPAC Traditional name: diethoxydiethylsilane
• Synonyms: Diethyldiethoxysilane; Diethoxydiethylsilane; 二乙基二乙氧基硅烷; 二乙氧基二乙基硅烷

Database IDs

• CAS Number: 5021-93-2
• EC Number: 225-706-8
• MDL Number: MFCD00026755
• Beilstein Number: 1739575
• PubChem SID: 162250786
• PubChem CID: 78726

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 1.803
• LogD (pH = 7.4): 1.803
• Log P: 1.803
• Molar Refractivity: 44.8136 cm^3
• Polarizability: 19.78241 Å^3
• Polar Surface Area: 18.46 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Flash Point: 30 °C; 86 °F
• Density: 0.858 g/mL at 20 °C(lit.)
• Refractive Index: n20/D 1.402

Safety Information

• European Hazard Symbols: Flammable (F); Irritant (Xi)
• UN Number: 1993
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 2
• Risk Statements: 11-36/38
• Safety Statements: 26-36
• GHS Pictograms: GHS02; GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H226-H315-H319
• GHS Precautionary statements: 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 2

Product Information

• Purity: ≥95% (GC)
• Grade: technical
• Empirical Formula (Hill Notation): C8H20O2Si