diethoxy[(5,5,6,6,7,7,8,8,9,9,10,10,10-tridecafluorodecan-2-yl)oxy]silane

• ChemBase ID: 295944
• Molecular Formular: C14H19F13O3Si
• Molecular Mass: 510.3636016
• Monoisotopic Mass: 510.08958786
• SMILES: CCO[SiH](OCC)OC(C)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• Canonical SMILES: CCO[SiH](OC(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C)OCC
• InChI: InChI=1S/C14H19F13O3Si/c1-4-28-31(29-5-2)30-8(3)6-7-9(15,16)10(17,18)11(19,20)12(21,22)13(23,24)14(25,26)27/h8,31H,4-7H2,1-3H3
• InChIKey: CSNOYOAXJIKLKM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: diethoxy[(5,5,6,6,7,7,8,8,9,9,10,10,10-tridecafluorodecan-2-yl)oxy]silane
• IUPAC Traditional name: diethoxy[(5,5,6,6,7,7,8,8,9,9,10,10,10-tridecafluorodecan-2-yl)oxy]silane
• Synonyms: Triethoxy-1H,1H,2H,2H-perfluorooctylsilane; 1H,1H,2H,2H-Perfluorooctyltriethoxysilane; 1H,1H,2H,2H-全氟辛基三乙氧基硅烷

Database IDs

• CAS Number: 51851-37-7
• EC Number: 257-473-3
• MDL Number: MFCD00042333
• PubChem SID: 180681475
• PubChem CID: 73995077

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 6.2485
• LogD (pH = 7.4): 6.2485
• Log P: 6.2485
• Molar Refractivity: 74.2672 cm^3
• Polarizability: 30.562912 Å^3
• Polar Surface Area: 27.69 Å^2
• Rotatable Bonds: 14
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: <-38°C
• Boiling Point: 220°C
• Flash Point: 97°C(206°F)
• Density: 1.333
• Refractive Index: 1.345

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/38
• Safety Statements: 26-37
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319
• GHS Precautionary statements: P280G-P305+P351+P338

Product Information

• Purity: 97%