tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane

C13H26O2Si — CID 11287979

IUPACtert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCC1C=CCCO1
InChIInChI=1S/C13H26O2Si/c1-13(2,3)16(4,5)15-11-9-12-8-6-7-10-14-12/h6,8,12H,7,9-11H2,1-5H3
InChIKeyXGOCKOAVNISZNK-UHFFFAOYSA-N
MW242.43 g/mol
LogP3.74
Rot. Bonds4

About tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane

tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane (PubChem CID 11287979) has the molecular formula C13H26O2Si and a molecular weight of 242.43 g/mol. Its IUPAC name is tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane
PubChem CID11287979
Molecular FormulaC13H26O2Si
Molecular Weight242.43 g/mol
Exact Mass242.17
IUPAC Nametert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCC1C=CCCO1
InChIInChI=1S/C13H26O2Si/c1-13(2,3)16(4,5)15-11-9-12-8-6-7-10-14-12/h6,8,12H,7,9-11H2,1-5H3
InChIKeyXGOCKOAVNISZNK-UHFFFAOYSA-N
XLogP3.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Silane, [(3,6-dihydro-2H-pyran-4-yl)oxy]trimethyl-
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2-(2,5-Dihydrofuran-2-yl)ethoxy-tri(propan-2-yl)silane
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tert-butyl-[[(2S,3S)-3-ethenyl-2-methyl-2,6-dihydropyran-3-yl]oxy]-dimethylsilane
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tert-butyl-[(2Z)-4-methoxy-6-methylhepta-2,5-dienoxy]-dimethylsilane
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tert-butyl-[[(2S,3R)-3-ethenyl-2-methyl-2,6-dihydropyran-3-yl]oxy]-dimethylsilane
CID 101083171
[(1S,2R,5R)-2-but-3-enoxy-5-[tert-butyl(dimethyl)silyl]oxycyclopent-3-en-1-yl]oxy-tert-butyl-dimethylsilane
CID 101193984
tert-butyl-[(1S,2R)-2-[tert-butyl(dimethyl)silyl]oxy-1-[(6R)-3,6-dihydro-2H-pyran-6-yl]but-3-enoxy]-dimethylsilane
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Tert-butyl-dimethyl-(2,3,4,7-tetrahydrooxepin-7-ylmethoxy)silane
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tert-butyl-dimethyl-[(E)-3-[(2R,3S)-3-methyloxiran-2-yl]prop-2-enoxy]silane
CID 134835508
tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane
CID 134836061
(3-Methoxycyclohexa-1,4-dien-1-yl)oxy-dimethyl-propan-2-ylsilane
CID 134906247
Tert-butyl-(3-methoxycyclohexa-1,4-dien-1-yl)oxy-dimethylsilane
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Frequently Asked Questions

What is the IUPAC name of tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane (CID 11287979) is tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCCC1C=CCCO1.
What is the InChIKey of tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane?
The InChIKey is XGOCKOAVNISZNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O2Si/c1-13(2,3)16(4,5)15-11-9-12-8-6-7-10-14-12/h6,8,12H,7,9-11H2,1-5H3.
What are the key properties of tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane?
tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane has a molecular weight of 242.43 g/mol, XLogP of 3.74, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-(3,6-dihydro-2H-pyran-6-yl)ethoxy]-dimethylsilane is sourced from PubChem (CID 11287979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).