tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane

C15H28O2Si — CID 10084417

IUPACtert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane
SMILESCC1(C)OC12CCCC=C2O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H28O2Si/c1-13(2,3)18(6,7)16-12-10-8-9-11-15(12)14(4,5)17-15/h10H,8-9,11H2,1-7H3
InChIKeyYIDYZKBBFBZEOE-UHFFFAOYSA-N
MW268.47 g/mol
LogP4.62
Rot. Bonds2

About tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane

tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane (PubChem CID 10084417) has the molecular formula C15H28O2Si and a molecular weight of 268.47 g/mol. Its IUPAC name is tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane
PubChem CID10084417
Molecular FormulaC15H28O2Si
Molecular Weight268.47 g/mol
Exact Mass268.19
IUPAC Nametert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane
SMILESCC1(C)OC12CCCC=C2O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H28O2Si/c1-13(2,3)18(6,7)16-12-10-8-9-11-15(12)14(4,5)17-15/h10H,8-9,11H2,1-7H3
InChIKeyYIDYZKBBFBZEOE-UHFFFAOYSA-N
XLogP4.62
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
CID 134889954
Trimethyl-[(1-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane
CID 12771792
(2,2-Dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy-trimethylsilane
CID 10013942
Tert-butyl-dimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane
CID 10015202
Tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane
CID 10037969
Trimethyl(1-oxaspiro[2.6]non-4-en-4-yloxy)silane
CID 10059049
(8-But-3-enyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy-trimethylsilane
CID 10060795
tert-butyl-dimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane
CID 10265045
Trimethyl-[(2-methyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]silane
CID 10398284
Tert-butyl-[(6-butyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]-dimethylsilane
CID 11055137
Trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane
CID 12771787

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane (CID 10084417) is tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane is CC1(C)OC12CCCC=C2O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane?
The InChIKey is YIDYZKBBFBZEOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2Si/c1-13(2,3)18(6,7)16-12-10-8-9-11-15(12)14(4,5)17-15/h10H,8-9,11H2,1-7H3.
What are the key properties of tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane?
tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane has a molecular weight of 268.47 g/mol, XLogP of 4.62, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane is sourced from PubChem (CID 10084417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).