[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane

C15H28F3NO4Si3 — CID 91700311

IUPAC[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane
SMILESCC(O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OCc1cccnc1)C(F)(F)F
InChIInChI=1S/C15H28F3NO4Si3/c1-13(15(16,17)18)21-25(4,5)23-26(6,7)22-24(2,3)20-12-14-9-8-10-19-11-14/h8-11,13H,12H2,1-7H3
InChIKeyHHTVHOHGLWIDAA-UHFFFAOYSA-N
MW427.64 g/mol
LogP4.70
Rot. Bonds9

About [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane

[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane (PubChem CID 91700311) has the molecular formula C15H28F3NO4Si3 and a molecular weight of 427.64 g/mol. Its IUPAC name is [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane.

Molecular Properties

Compound Name[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane
PubChem CID91700311
Molecular FormulaC15H28F3NO4Si3
Molecular Weight427.64 g/mol
Exact Mass427.13
IUPAC Name[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane
SMILESCC(O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OCc1cccnc1)C(F)(F)F
InChIInChI=1S/C15H28F3NO4Si3/c1-13(15(16,17)18)21-25(4,5)23-26(6,7)22-24(2,3)20-12-14-9-8-10-19-11-14/h8-11,13H,12H2,1-7H3
InChIKeyHHTVHOHGLWIDAA-UHFFFAOYSA-N
XLogP4.70
TPSA49.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.64
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane?
The IUPAC name of [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane (CID 91700311) is [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane.
What is the SMILES notation for [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane?
The canonical SMILES for [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane is CC(O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OCc1cccnc1)C(F)(F)F.
What is the InChIKey of [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane?
The InChIKey is HHTVHOHGLWIDAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28F3NO4Si3/c1-13(15(16,17)18)21-25(4,5)23-26(6,7)22-24(2,3)20-12-14-9-8-10-19-11-14/h8-11,13H,12H2,1-7H3.
What are the key properties of [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane?
[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane has a molecular weight of 427.64 g/mol, XLogP of 4.70, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(pyridin-3-ylmethoxy)silyl]oxy-[dimethyl(1,1,1-trifluoropropan-2-yloxy)silyl]oxy-dimethylsilane is sourced from PubChem (CID 91700311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).