tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane

C13H26O3Si — CID 134836061

IUPACtert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane
SMILESCOC1=CCOC1[C@H](C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H26O3Si/c1-10(12-11(14-5)8-9-15-12)16-17(6,7)13(2,3)4/h8,10,12H,9H2,1-7H3/t10-,12?/m0/s1
InChIKeyXVFSWYUGLNDPSF-NUHJPDEHSA-N
MW258.43 g/mol
LogP3.33
Rot. Bonds4

About tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane

tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane (PubChem CID 134836061) has the molecular formula C13H26O3Si and a molecular weight of 258.43 g/mol. Its IUPAC name is tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane
PubChem CID134836061
Molecular FormulaC13H26O3Si
Molecular Weight258.43 g/mol
Exact Mass258.17
IUPAC Nametert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane
SMILESCOC1=CCOC1[C@H](C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H26O3Si/c1-10(12-11(14-5)8-9-15-12)16-17(6,7)13(2,3)4/h8,10,12H,9H2,1-7H3/t10-,12?/m0/s1
InChIKeyXVFSWYUGLNDPSF-NUHJPDEHSA-N
XLogP3.33
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.43
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane (CID 134836061) is tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane is COC1=CCOC1[C@H](C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane?
The InChIKey is XVFSWYUGLNDPSF-NUHJPDEHSA-N. The full InChI is InChI=1S/C13H26O3Si/c1-10(12-11(14-5)8-9-15-12)16-17(6,7)13(2,3)4/h8,10,12H,9H2,1-7H3/t10-,12?/m0/s1.
What are the key properties of tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane?
tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane has a molecular weight of 258.43 g/mol, XLogP of 3.33, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane is sourced from PubChem (CID 134836061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).