tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane

C16H30O2Si — CID 100957903

IUPACtert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane
SMILESCOCC1=C(C)C2CCCC12O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30O2Si/c1-12-13-9-8-10-16(13,14(12)11-17-5)18-19(6,7)15(2,3)4/h13H,8-11H2,1-7H3
InChIKeyUFLQICOXSIDHBG-UHFFFAOYSA-N
MW282.50 g/mol
LogP4.52
Rot. Bonds4

About tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane

tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane (PubChem CID 100957903) has the molecular formula C16H30O2Si and a molecular weight of 282.50 g/mol. Its IUPAC name is tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane
PubChem CID100957903
Molecular FormulaC16H30O2Si
Molecular Weight282.50 g/mol
Exact Mass282.20
IUPAC Nametert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane
SMILESCOCC1=C(C)C2CCCC12O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30O2Si/c1-12-13-9-8-10-16(13,14(12)11-17-5)18-19(6,7)15(2,3)4/h13H,8-11H2,1-7H3
InChIKeyUFLQICOXSIDHBG-UHFFFAOYSA-N
XLogP4.52
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.50
LogP ≤ 54.52
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-dimethyl-[[(1S,5R)-7-(prop-2-enoxymethyl)-1-bicyclo[3.2.0]hept-6-enyl]oxy]silane
CID 12111604
tert-butyl-[(1S,2R)-1-(2,5-dihydrofuran-3-yl)-2-ethenylcyclopentyl]oxy-dimethylsilane
CID 12111605
Tert-butyl-[[7-(methoxymethyl)-6-trimethylsilyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane
CID 100957902
[1-Methoxy-7-(methoxymethyl)-6-bicyclo[3.2.0]hept-6-enyl]-trimethylsilane
CID 100957904
1-Methoxy-7-(methoxymethyl)-6-methylbicyclo[3.2.0]hept-6-ene
CID 100957905
1-Methoxy-7-(methoxymethyl)-6-propan-2-ylbicyclo[3.2.0]hept-6-ene
CID 100957906
[(1S,5R)-7-(but-3-enoxymethyl)-1-bicyclo[3.2.0]hept-6-enyl]oxy-tert-butyl-dimethylsilane
CID 101270899
tert-butyl-[(1S,2R)-1-(3,6-dihydro-2H-pyran-5-yl)-2-ethenylcyclopentyl]oxy-dimethylsilane
CID 101270902

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane (CID 100957903) is tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane is COCC1=C(C)C2CCCC12O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane?
The InChIKey is UFLQICOXSIDHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O2Si/c1-12-13-9-8-10-16(13,14(12)11-17-5)18-19(6,7)15(2,3)4/h13H,8-11H2,1-7H3.
What are the key properties of tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane?
tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane has a molecular weight of 282.50 g/mol, XLogP of 4.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[7-(methoxymethyl)-6-methyl-1-bicyclo[3.2.0]hept-6-enyl]oxy]-dimethylsilane is sourced from PubChem (CID 100957903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).