tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane

C15H35FO2Si2 — CID 91747108

IUPACtert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCC(CF)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H35FO2Si2/c1-14(2,3)19(7,8)17-12-13(11-16)18-20(9,10)15(4,5)6/h13H,11-12H2,1-10H3
InChIKeyUWMLDIXYLXKGGZ-UHFFFAOYSA-N
MW322.61 g/mol
LogP5.37
Rot. Bonds6

About tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane

tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane (PubChem CID 91747108) has the molecular formula C15H35FO2Si2 and a molecular weight of 322.61 g/mol. Its IUPAC name is tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane
PubChem CID91747108
Molecular FormulaC15H35FO2Si2
Molecular Weight322.61 g/mol
Exact Mass322.22
IUPAC Nametert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCC(CF)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H35FO2Si2/c1-14(2,3)19(7,8)17-12-13(11-16)18-20(9,10)15(4,5)6/h13H,11-12H2,1-10H3
InChIKeyUWMLDIXYLXKGGZ-UHFFFAOYSA-N
XLogP5.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.61
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane (CID 91747108) is tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane is CC(C)(C)[Si](C)(C)OCC(CF)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane?
The InChIKey is UWMLDIXYLXKGGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H35FO2Si2/c1-14(2,3)19(7,8)17-12-13(11-16)18-20(9,10)15(4,5)6/h13H,11-12H2,1-10H3.
What are the key properties of tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane?
tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane has a molecular weight of 322.61 g/mol, XLogP of 5.37, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-3-fluoropropan-2-yl]oxy-dimethylsilane is sourced from PubChem (CID 91747108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).