tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane

C15H28O2Si — CID 135039648

IUPACtert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane
SMILESC=CC1OC(O[Si](C)(C)C(C)(C)C)C2CCC1C2
InChIInChI=1S/C15H28O2Si/c1-7-13-11-8-9-12(10-11)14(16-13)17-18(5,6)15(2,3)4/h7,11-14H,1,8-10H2,2-6H3
InChIKeyIGWTZANBSYCCIV-UHFFFAOYSA-N
MW268.47 g/mol
LogP4.34
Rot. Bonds3

About tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane

tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane (PubChem CID 135039648) has the molecular formula C15H28O2Si and a molecular weight of 268.47 g/mol. Its IUPAC name is tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane
PubChem CID135039648
Molecular FormulaC15H28O2Si
Molecular Weight268.47 g/mol
Exact Mass268.19
IUPAC Nametert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane
SMILESC=CC1OC(O[Si](C)(C)C(C)(C)C)C2CCC1C2
InChIInChI=1S/C15H28O2Si/c1-7-13-11-8-9-12(10-11)14(16-13)17-18(5,6)15(2,3)4/h7,11-14H,1,8-10H2,2-6H3
InChIKeyIGWTZANBSYCCIV-UHFFFAOYSA-N
XLogP4.34
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.34
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

tert-butyl-[(2R,3R,4R)-2-ethenyl-4-methoxyoxolan-3-yl]oxy-dimethylsilane
CID 178070071
tert-butyl-dimethyl-[[(5R)-6-oxabicyclo[3.1.0]hexan-3-yl]oxy]silane
CID 89397580
[(2R,4R,5R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-prop-2-enyloxan-3-yl]oxy-tert-butyl-dimethylsilane
CID 140547133
4-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carbaldehyde
CID 14561357
tert-butyl-[(1S,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]oxy-dimethylsilane;tert-butyl-[(1R,2R)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]oxy-dimethylsilane
CID 158464609
[(1R,2S,3aS)-1-ethenyl-1,2,3,3a,4,5-hexahydropentalen-2-yl]oxy-tert-butyl-dimethylsilane
CID 10061373
2-[(2S,5R,6S)-6-[tert-butyl(dimethyl)silyl]oxy-5-methyloxan-2-yl]acetaldehyde
CID 10967662
tert-butyl-dimethyl-[(2S,3R,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxysilane
CID 59441458
tert-butyl-dimethyl-[[(2R,5R)-5-prop-2-enyloxolan-2-yl]methoxy]silane
CID 71665104
tert-butyl-[3-[(2R,3R)-3-ethenyloxiran-2-yl]-2-methylpropoxy]-dimethylsilane
CID 54455655
(E)-1-[(1R,2S,3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-ethenylcyclopentyl]oct-1-en-3-ol
CID 101200500
tert-butyl-dimethyl-[[(1R,2R,3S,5S)-2-pyrrolidin-1-yl-3-bicyclo[3.2.1]octanyl]oxy]silane
CID 102181386

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane (CID 135039648) is tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane is C=CC1OC(O[Si](C)(C)C(C)(C)C)C2CCC1C2.
What is the InChIKey of tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane?
The InChIKey is IGWTZANBSYCCIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2Si/c1-7-13-11-8-9-12(10-11)14(16-13)17-18(5,6)15(2,3)4/h7,11-14H,1,8-10H2,2-6H3.
What are the key properties of tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane?
tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane has a molecular weight of 268.47 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(4-ethenyl-3-oxabicyclo[3.2.1]octan-2-yl)oxy]-dimethylsilane is sourced from PubChem (CID 135039648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).