tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane

C15H30O2Si — CID 71605498

IUPACtert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane
SMILESCCOC1=CCC(O[Si](C)(C)C(C)(C)C)C1(C)C
InChIInChI=1S/C15H30O2Si/c1-9-16-12-10-11-13(15(12,5)6)17-18(7,8)14(2,3)4/h10,13H,9,11H2,1-8H3
InChIKeySNSRRDQWHRKNHG-UHFFFAOYSA-N
MW270.49 g/mol
LogP4.73
Rot. Bonds4

About tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane

tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane (PubChem CID 71605498) has the molecular formula C15H30O2Si and a molecular weight of 270.49 g/mol. Its IUPAC name is tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane
PubChem CID71605498
Molecular FormulaC15H30O2Si
Molecular Weight270.49 g/mol
Exact Mass270.20
IUPAC Nametert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane
SMILESCCOC1=CCC(O[Si](C)(C)C(C)(C)C)C1(C)C
InChIInChI=1S/C15H30O2Si/c1-9-16-12-10-11-13(15(12,5)6)17-18(7,8)14(2,3)4/h10,13H,9,11H2,1-8H3
InChIKeySNSRRDQWHRKNHG-UHFFFAOYSA-N
XLogP4.73
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.49
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane?
The IUPAC name of tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane (CID 71605498) is tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane?
The canonical SMILES for tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane is CCOC1=CCC(O[Si](C)(C)C(C)(C)C)C1(C)C.
What is the InChIKey of tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane?
The InChIKey is SNSRRDQWHRKNHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O2Si/c1-9-16-12-10-11-13(15(12,5)6)17-18(7,8)14(2,3)4/h10,13H,9,11H2,1-8H3.
What are the key properties of tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane?
tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane has a molecular weight of 270.49 g/mol, XLogP of 4.73, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(3-ethoxy-2,2-dimethylcyclopent-3-en-1-yl)oxy-dimethylsilane is sourced from PubChem (CID 71605498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).