(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)trimethoxysilane

• ChemBase ID: 94634
• Molecular Formular: C13H13F17O3Si
• Molecular Mass: 568.2988744
• Monoisotopic Mass: 568.03625055
• SMILES: [Si](CCC(F)(F)C(F)(F)C(F)(C(C(F)(F)C(C(C(F)(F)F)(F)F)(F)F)(F)F)F)(OC)(OC)OC
• Canonical SMILES: CO[Si](CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OC)OC
• InChI: InChI=1S/C13H13F17O3Si/c1-31-34(32-2,33-3)5-4-6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)12(26,27)13(28,29)30/h4-5H2,1-3H3
• InChIKey: HJIMAFKWSKZMBK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)trimethoxysilane
• IUPAC Traditional name: (3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)trimethoxysilane
• Synonyms: 1H,1H,2H,2H-Perfluorodecyltrimethoxysilane 97%; (3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)triMethoxy-Silane; 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-十七氟癸基三甲氧基硅烷

Database IDs

• CAS Number: 83048-65-1
• MDL Number: MFCD07368748
• PubChem SID: 162081288
• PubChem CID: 2782918

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 7.66
• LogD (pH = 7.4): 7.66
• Log P: 7.66
• Molar Refractivity: 69.1677 cm^3
• Polarizability: 29.260067 Å^3
• Polar Surface Area: 27.69 Å^2
• Rotatable Bonds: 13
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Boiling Point: 83-84°C/1mm

Safety Information

• Storage Warning: Corrosive