tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane

C18H40O4Si2 — CID 146020066

IUPACtert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane
SMILESCO[C@H]1C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO[Si](C)(C)C(C)(C)C)O1
InChIInChI=1S/C18H40O4Si2/c1-17(2,3)23(8,9)20-13-15-14(12-16(19-7)21-15)22-24(10,11)18(4,5)6/h14-16H,12-13H2,1-11H3/t14-,15+,16+/m0/s1
InChIKeySPMUOWIEEIITPA-ARFHVFGLSA-N
MW376.69 g/mol
LogP5.16
Rot. Bonds6

About tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane

tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane (PubChem CID 146020066) has the molecular formula C18H40O4Si2 and a molecular weight of 376.69 g/mol. Its IUPAC name is tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane
PubChem CID146020066
Molecular FormulaC18H40O4Si2
Molecular Weight376.69 g/mol
Exact Mass376.25
IUPAC Nametert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane
SMILESCO[C@H]1C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO[Si](C)(C)C(C)(C)C)O1
InChIInChI=1S/C18H40O4Si2/c1-17(2,3)23(8,9)20-13-15-14(12-16(19-7)21-15)22-24(10,11)18(4,5)6/h14-16H,12-13H2,1-11H3/t14-,15+,16+/m0/s1
InChIKeySPMUOWIEEIITPA-ARFHVFGLSA-N
XLogP5.16
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.69
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane (CID 146020066) is tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane is CO[C@H]1C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO[Si](C)(C)C(C)(C)C)O1.
What is the InChIKey of tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane?
The InChIKey is SPMUOWIEEIITPA-ARFHVFGLSA-N. The full InChI is InChI=1S/C18H40O4Si2/c1-17(2,3)23(8,9)20-13-15-14(12-16(19-7)21-15)22-24(10,11)18(4,5)6/h14-16H,12-13H2,1-11H3/t14-,15+,16+/m0/s1.
What are the key properties of tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane?
tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane has a molecular weight of 376.69 g/mol, XLogP of 5.16, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxyoxolan-2-yl]methoxy]-dimethylsilane is sourced from PubChem (CID 146020066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).