triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane

C38H32AlF3O3Si2 — CID 139784756

IUPACtriphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane
SMILESFC(F)(F)CO[Al](O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/2C18H15OSi.C2H2F3O.Al/c2*19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;3-2(4,5)1-6;/h2*1-15H;1H2;/q3*-1;+3
InChIKeyGSZGBKKZGKORJO-UHFFFAOYSA-N
MW676.82 g/mol
LogP4.92
Rot. Bonds12

About triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane

triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane (PubChem CID 139784756) has the molecular formula C38H32AlF3O3Si2 and a molecular weight of 676.82 g/mol. Its IUPAC name is triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane.

Molecular Properties

Compound Nametriphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane
PubChem CID139784756
Molecular FormulaC38H32AlF3O3Si2
Molecular Weight676.82 g/mol
Exact Mass676.17
IUPAC Nametriphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane
SMILESFC(F)(F)CO[Al](O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/2C18H15OSi.C2H2F3O.Al/c2*19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;3-2(4,5)1-6;/h2*1-15H;1H2;/q3*-1;+3
InChIKeyGSZGBKKZGKORJO-UHFFFAOYSA-N
XLogP4.92
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms47
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500676.82
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

triphenyl(4,4,4-trifluorobutoxy)silane
CID 150215925
3-[phenyl-bis(2,2,2-trifluoroethoxy)silyl]propan-1-amine
CID 54356096
[diphenyl-[2-(2,2,2-trifluoroethyl)phenyl]silyl]oxy-diphenyl-[2-(2,2,2-trifluoroethyl)phenyl]silane
CID 87903597
(2-methylpropan-2-yl)oxy-[4-[(2-methylpropan-2-yl)oxy-diphenylsilyl]phenyl]-diphenylsilane
CID 87143933
triphenyl-(4-triphenylsilyloxyphenoxy)silane
CID 86209033
diphenyl-bis(trifluoromethyl)silane
CID 13186519
triphenyl-(2-triphenylsilyloxyphenoxy)silane
CID 154164167
triphenyl(silyloxy)silane
CID 123924949
difluoro-phenyl-(2,2,2-trifluoroethoxy)phosphanium
CID 23234580
trifluoro-phenyl-(2,2,2-trifluoroethoxy)-λ5-phosphane
CID 23413804
1-phenyl-N-(2,2,2-trifluoroethoxy)ethanimine
CID 173208454
triphenylsilyloxyaluminum(2+) dichloride
CID 173433919

Frequently Asked Questions

What is the IUPAC name of triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane?
The IUPAC name of triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane (CID 139784756) is triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane.
What is the SMILES notation for triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane?
The canonical SMILES for triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane is FC(F)(F)CO[Al](O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane?
The InChIKey is GSZGBKKZGKORJO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H15OSi.C2H2F3O.Al/c2*19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;3-2(4,5)1-6;/h2*1-15H;1H2;/q3*-1;+3.
What are the key properties of triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane?
triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane has a molecular weight of 676.82 g/mol, XLogP of 4.92, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[2,2,2-trifluoroethoxy(triphenylsilyloxy)alumanyl]oxysilane is sourced from PubChem (CID 139784756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).