tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane

C14H26O2Si — CID 10037969

IUPACtert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane
SMILESCC(C)(C)[Si](C)(C)OC1=CCCCCC12CO2
InChIInChI=1S/C14H26O2Si/c1-13(2,3)17(4,5)16-12-9-7-6-8-10-14(12)11-15-14/h9H,6-8,10-11H2,1-5H3
InChIKeyQJNCQDBCUBEKNN-UHFFFAOYSA-N
MW254.45 g/mol
LogP4.24
Rot. Bonds2

About tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane

tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane (PubChem CID 10037969) has the molecular formula C14H26O2Si and a molecular weight of 254.45 g/mol. Its IUPAC name is tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane
PubChem CID10037969
Molecular FormulaC14H26O2Si
Molecular Weight254.45 g/mol
Exact Mass254.17
IUPAC Nametert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane
SMILESCC(C)(C)[Si](C)(C)OC1=CCCCCC12CO2
InChIInChI=1S/C14H26O2Si/c1-13(2,3)17(4,5)16-12-9-7-6-8-10-14(12)11-15-14/h9H,6-8,10-11H2,1-5H3
InChIKeyQJNCQDBCUBEKNN-UHFFFAOYSA-N
XLogP4.24
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.45
LogP ≤ 54.24
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-[[(1R,4S,6R)-1-methyl-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
CID 11644380
trimethyl-[[(1S,4R,6S)-1-methyl-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
CID 46839064
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
Trimethyl(1-oxaspiro[2.6]non-4-en-4-yloxy)silane
CID 10059049
Tert-butyl-[(2,2-dimethyl-1-oxaspiro[2.5]oct-4-en-4-yl)oxy]-dimethylsilane
CID 10084417
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
trimethyl-[[(4E)-1-oxaspiro[2.7]dec-4-en-4-yl]oxy]silane
CID 10398808
Tert-butyl-dimethyl-[(6-pent-4-enyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane
CID 10968422

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane?
The IUPAC name of tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane (CID 10037969) is tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane is CC(C)(C)[Si](C)(C)OC1=CCCCCC12CO2.
What is the InChIKey of tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane?
The InChIKey is QJNCQDBCUBEKNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2Si/c1-13(2,3)17(4,5)16-12-9-7-6-8-10-14(12)11-15-14/h9H,6-8,10-11H2,1-5H3.
What are the key properties of tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane?
tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane has a molecular weight of 254.45 g/mol, XLogP of 4.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(1-oxaspiro[2.6]non-4-en-4-yloxy)silane is sourced from PubChem (CID 10037969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).