diethoxybis[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]silane

• ChemBase ID: 15262
• Molecular Formular: C18H10F14O2Si
• Molecular Mass: 552.3339448
• Monoisotopic Mass: 552.02265117
• SMILES: [Si](OCC)(OCC)(c1c(c(c(c(c1F)F)C(F)(F)F)F)F)c1c(c(c(c(c1F)F)C(F)(F)F)F)F
• Canonical SMILES: CCO[Si](c1c(F)c(F)c(c(c1F)F)C(F)(F)F)(c1c(F)c(F)c(c(c1F)F)C(F)(F)F)OCC
• InChI: InChI=1S/C18H10F14O2Si/c1-3-33-35(34-4-2,15-11(23)7(19)5(17(27,28)29)8(20)12(15)24)16-13(25)9(21)6(18(30,31)32)10(22)14(16)26/h3-4H2,1-2H3
• InChIKey: OWTBYQCFUUXZMA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: diethoxybis[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]silane
• IUPAC Traditional name: diethoxybis[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]silane
• Synonyms: Diethoxybis(4-perfluorotolyl)silane

Database IDs

• MDL Number: MFCD06246860
• PubChem SID: 160978569
• PubChem CID: 2769653

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 7.6214
• LogD (pH = 7.4): 7.6214
• Log P: 7.6214
• Molar Refractivity: 88.2182 cm^3
• Polarizability: 33.53805 Å^3
• Polar Surface Area: 18.46 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Warning: IRRITANT, CORROSIVE
• TSCA Listed: false

Product Information

• Purity: 97%