tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane

C13H26OSi — CID 86221547

IUPACtert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCC1C=CCC1
InChIInChI=1S/C13H26OSi/c1-13(2,3)15(4,5)14-11-10-12-8-6-7-9-12/h6,8,12H,7,9-11H2,1-5H3
InChIKeyMENUPXPXDQYVOP-UHFFFAOYSA-N
MW226.44 g/mol
LogP4.36
Rot. Bonds4

About tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane

tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane (PubChem CID 86221547) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane
PubChem CID86221547
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Nametert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCC1C=CCC1
InChIInChI=1S/C13H26OSi/c1-13(2,3)15(4,5)14-11-10-12-8-6-7-9-12/h6,8,12H,7,9-11H2,1-5H3
InChIKeyMENUPXPXDQYVOP-UHFFFAOYSA-N
XLogP4.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane (CID 86221547) is tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane is CC(C)(C)[Si](C)(C)OCCC1C=CCC1.
What is the InChIKey of tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane?
The InChIKey is MENUPXPXDQYVOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-13(2,3)15(4,5)14-11-10-12-8-6-7-9-12/h6,8,12H,7,9-11H2,1-5H3.
What are the key properties of tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane?
tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane has a molecular weight of 226.44 g/mol, XLogP of 4.36, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(2-cyclopent-2-en-1-ylethoxy)-dimethylsilane is sourced from PubChem (CID 86221547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).