tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane

C16H38O2Si2 — CID 91747107

IUPACtert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane
SMILESCCC(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H38O2Si2/c1-12-14(18-20(10,11)16(5,6)7)13-17-19(8,9)15(2,3)4/h14H,12-13H2,1-11H3
InChIKeyDJXHCHJEKDCSJZ-UHFFFAOYSA-N
MW318.65 g/mol
LogP5.81
Rot. Bonds6

About tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane

tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane (PubChem CID 91747107) has the molecular formula C16H38O2Si2 and a molecular weight of 318.65 g/mol. Its IUPAC name is tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane
PubChem CID91747107
Molecular FormulaC16H38O2Si2
Molecular Weight318.65 g/mol
Exact Mass318.24
IUPAC Nametert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane
SMILESCCC(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H38O2Si2/c1-12-14(18-20(10,11)16(5,6)7)13-17-19(8,9)15(2,3)4/h14H,12-13H2,1-11H3
InChIKeyDJXHCHJEKDCSJZ-UHFFFAOYSA-N
XLogP5.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.65
LogP ≤ 55.81
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]oxybutan-2-yloxy]-dimethylsilane?
The IUPAC name of tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane (CID 91747107) is tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane is CCC(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane?
The InChIKey is DJXHCHJEKDCSJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H38O2Si2/c1-12-14(18-20(10,11)16(5,6)7)13-17-19(8,9)15(2,3)4/h14H,12-13H2,1-11H3.
What are the key properties of tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane?
tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxy]-dimethylsilane has a molecular weight of 318.65 g/mol, XLogP of 5.81, 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]oxybutan-2-yloxy]-dimethylsilane is sourced from PubChem (CID 91747107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).