[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane

C18H24F3NO3Si2 — CID 91700187

IUPAC[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane
SMILESC[Si](C)(OCc1cccnc1)O[Si](C)(C)OCc1ccccc1C(F)(F)F
InChIInChI=1S/C18H24F3NO3Si2/c1-26(2,23-13-15-8-7-11-22-12-15)25-27(3,4)24-14-16-9-5-6-10-17(16)18(19,20)21/h5-12H,13-14H2,1-4H3
InChIKeyMDAUWTOKBAROEN-UHFFFAOYSA-N
MW415.56 g/mol
LogP5.25
Rot. Bonds8

About [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane

[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane (PubChem CID 91700187) has the molecular formula C18H24F3NO3Si2 and a molecular weight of 415.56 g/mol. Its IUPAC name is [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane.

Molecular Properties

Compound Name[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane
PubChem CID91700187
Molecular FormulaC18H24F3NO3Si2
Molecular Weight415.56 g/mol
Exact Mass415.12
IUPAC Name[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane
SMILESC[Si](C)(OCc1cccnc1)O[Si](C)(C)OCc1ccccc1C(F)(F)F
InChIInChI=1S/C18H24F3NO3Si2/c1-26(2,23-13-15-8-7-11-22-12-15)25-27(3,4)24-14-16-9-5-6-10-17(16)18(19,20)21/h5-12H,13-14H2,1-4H3
InChIKeyMDAUWTOKBAROEN-UHFFFAOYSA-N
XLogP5.25
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.56
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2,6-Diethylphenyl)(3-pyridinyl)methanol
CID 3610631
(2-Methylphenyl)(3-pyridinyl)methanol
CID 4179630
2-[(4-Fluorophenyl)methyl]-1-pyridin-3-ylhexan-1-ol
CID 19775352
Trimethyl-(2,2,2-trifluoro-1-phenyl-1-pyridin-2-ylethoxy)silane
CID 11163162
Trifluoromethanesulfonate;trimethyl-[phenyl(pyridin-1-ium-1-yl)methoxy]silane
CID 134886132
(1S,2R)-1-pyridin-3-yl-2-[4-(trifluoromethyl)phenyl]but-3-en-1-ol
CID 134956854
(2R)-2-(2-fluoro-3-pyridinyl)-4-phenylbutan-2-ol
CID 134966032
Triethyl-[(4-fluorophenyl)-(5-phenyl-3-pyridinyl)methoxy]silane
CID 135067167
Dimethyl(2-hydroxy-2-phenylethyl)(2-pyridyl)silane
CID 10901287
3-(((Tert-butyldimethylsilyl)oxy)methyl)pyridine
CID 17962382
3-([(3-([2-Fluoro-6-(trifluoromethyl)benzyl]oxy)-1,1,3,3-tetramethyldisiloxanyl)oxy]methyl)pyridine
CID 91700195
3-([(5-([2-Fluoro-6-(trifluoromethyl)benzyl]oxy)-1,1,3,3,5,5-hexamethyltrisiloxanyl)oxy]methyl)pyridine
CID 91700221

Frequently Asked Questions

What is the IUPAC name of [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane?
The IUPAC name of [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane (CID 91700187) is [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane.
What is the SMILES notation for [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane?
The canonical SMILES for [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane is C[Si](C)(OCc1cccnc1)O[Si](C)(C)OCc1ccccc1C(F)(F)F.
What is the InChIKey of [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane?
The InChIKey is MDAUWTOKBAROEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24F3NO3Si2/c1-26(2,23-13-15-8-7-11-22-12-15)25-27(3,4)24-14-16-9-5-6-10-17(16)18(19,20)21/h5-12H,13-14H2,1-4H3.
What are the key properties of [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane?
[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane has a molecular weight of 415.56 g/mol, XLogP of 5.25, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethyl-[[2-(trifluoromethyl)phenyl]methoxy]silane is sourced from PubChem (CID 91700187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).