6,6,8,8-tetramethyl-1,13-bis(oxiran-2-yl)-2,7,12-trioxa-6,8-disilatridecane

• ChemBase ID: 112191
• Molecular Formular: C16H34O5Si2
• Molecular Mass: 362.60916
• Monoisotopic Mass: 362.19447725
• SMILES: C[Si](C)(CCCOCC1CO1)O[Si](C)(C)CCCOCC1CO1
• Canonical SMILES: C[Si](O[Si](CCCOCC1OC1)(C)C)(CCCOCC1OC1)C
• InChI: InChI=1S/C16H34O5Si2/c1-22(2,9-5-7-17-11-15-13-19-15)21-23(3,4)10-6-8-18-12-16-14-20-16/h15-16H,5-14H2,1-4H3
• InChIKey: MFIBZDZRPYQXOM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6,6,8,8-tetramethyl-1,13-bis(oxiran-2-yl)-2,7,12-trioxa-6,8-disilatridecane
• IUPAC Traditional name: 6,6,8,8-tetramethyl-1,13-bis(oxiran-2-yl)-2,7,12-trioxa-6,8-disilatridecane
• Synonyms: 1,3-bis(3-GLYCIDOXYPROPYL) TETRAMETHYL DISILOXANE; 1,3-Bis(3-glycidyloxypropyl)tetramethyldisiloxane; 1,3-双(3-缩水甘油醚氧基丙基)四甲基二硅氧烷

Database IDs

• CAS Number: 126-80-7
• EC Number: 204-803-9
• MDL Number: MFCD00039672
• Beilstein Number: 223966
• PubChem SID: 162097523; 24848903
• PubChem CID: 61068

CALCULATED PROPERTIES

• H Acceptors: 5
• H Donor: 0
• LogD (pH = 5.5): 2.188
• LogD (pH = 7.4): 2.188
• Log P: 2.188
• Molar Refractivity: 85.2824 cm^3
• Polarizability: 38.115574 Å^3
• Polar Surface Area: 52.75 Å^2
• Rotatable Bonds: 14
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 184 °C/2 mmHg(lit.)
• Flash Point: 150 °C; 302 °F
• Density: 0.996 g/mL at 20 °C(lit.)
• Refractive Index: n20/D 1.452

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Product Information

• Purity: ≥95.0% (GC)
• Empirical Formula (Hill Notation): C16H34O5Si2

DETAILS

MP Biomedicals - 05222858

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 14845

Packaging
100 mL in glass bottle