tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane

C14H26O3Si — CID 11425711

IUPACtert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)O[C@@H]1C=CC2(CC1)OCCO2
InChIInChI=1S/C14H26O3Si/c1-13(2,3)18(4,5)17-12-6-8-14(9-7-12)15-10-11-16-14/h6,8,12H,7,9-11H2,1-5H3/t12-/m1/s1
InChIKeyYWWXIYRSFZHTKU-GFCCVEGCSA-N
MW270.44 g/mol
LogP3.47
Rot. Bonds2

About tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane

tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane (PubChem CID 11425711) has the molecular formula C14H26O3Si and a molecular weight of 270.44 g/mol. Its IUPAC name is tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane
PubChem CID11425711
Molecular FormulaC14H26O3Si
Molecular Weight270.44 g/mol
Exact Mass270.17
IUPAC Nametert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)O[C@@H]1C=CC2(CC1)OCCO2
InChIInChI=1S/C14H26O3Si/c1-13(2,3)18(4,5)17-12-6-8-14(9-7-12)15-10-11-16-14/h6,8,12H,7,9-11H2,1-5H3/t12-/m1/s1
InChIKeyYWWXIYRSFZHTKU-GFCCVEGCSA-N
XLogP3.47
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.44
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane (CID 11425711) is tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane is CC(C)(C)[Si](C)(C)O[C@@H]1C=CC2(CC1)OCCO2.
What is the InChIKey of tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane?
The InChIKey is YWWXIYRSFZHTKU-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H26O3Si/c1-13(2,3)18(4,5)17-12-6-8-14(9-7-12)15-10-11-16-14/h6,8,12H,7,9-11H2,1-5H3/t12-/m1/s1.
What are the key properties of tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane?
tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane has a molecular weight of 270.44 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(8S)-1,4-dioxaspiro[4.5]dec-6-en-8-yl]oxy]-dimethylsilane is sourced from PubChem (CID 11425711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).