tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane

C15H28OSi — CID 54477997

IUPACtert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane
SMILESCC(C)(C)[Si](C)(C)O[C@@H]1CC=CC12CCCC2
InChIInChI=1S/C15H28OSi/c1-14(2,3)17(4,5)16-13-9-8-12-15(13)10-6-7-11-15/h8,12-13H,6-7,9-11H2,1-5H3/t13-/m1/s1
InChIKeyXMYJKPGQIOMXBG-CYBMUJFWSA-N
MW252.47 g/mol
LogP4.90
Rot. Bonds2

About tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane

tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane (PubChem CID 54477997) has the molecular formula C15H28OSi and a molecular weight of 252.47 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane
PubChem CID54477997
Molecular FormulaC15H28OSi
Molecular Weight252.47 g/mol
Exact Mass252.19
IUPAC Nametert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane
SMILESCC(C)(C)[Si](C)(C)O[C@@H]1CC=CC12CCCC2
InChIInChI=1S/C15H28OSi/c1-14(2,3)17(4,5)16-13-9-8-12-15(13)10-6-7-11-15/h8,12-13H,6-7,9-11H2,1-5H3/t13-/m1/s1
InChIKeyXMYJKPGQIOMXBG-CYBMUJFWSA-N
XLogP4.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.47
LogP ≤ 54.90
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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Related Compounds

7-Bicyclo[2.2.1]hept-2-enyloxy-tert-butyl-dimethylsilane
CID 15418774
1-(1-Butylcyclopentyl)prop-2-enoxy-trimethylsilane
CID 20565060
Tert-butyl-dimethyl-spiro[4.4]non-1-en-4-yloxysilane
CID 67760573
7-Bicyclo[2.2.1]hept-2-enyloxy-bis(ethenyl)-methylsilane
CID 69409686
1-Bicyclo[2.2.1]hept-2-enylmethoxy-ethenyl-dimethylsilane
CID 69411007
7-Bicyclo[2.2.1]hept-2-enyloxy-ethenyl-dimethylsilane
CID 69412795
tert-butyl-dimethyl-[(1S,2R)-2-propylcyclopent-3-en-1-yl]oxysilane
CID 89878114
Tert-butyl-(1-cyclopent-2-en-1-ylbutoxy)-dimethylsilane
CID 140346883
[3,3-bis[(10Z,13Z)-nonadeca-10,13-dienyl]cyclopentyl]oxy-tert-butyl-dimethylsilane
CID 140956873
[3,3-bis[(9Z,12Z)-octadeca-9,12-dienyl]cyclopentyl]oxy-tert-butyl-dimethylsilane
CID 140956890
Tert-butyl-(6,6-dimethylcyclohex-3-en-1-yl)oxy-dimethylsilane
CID 173552065
Tert-butyl-dimethyl-spiro[4.5]dec-7-en-10-yloxysilane
CID 173885795

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane (CID 54477997) is tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane is CC(C)(C)[Si](C)(C)O[C@@H]1CC=CC12CCCC2.
What is the InChIKey of tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane?
The InChIKey is XMYJKPGQIOMXBG-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H28OSi/c1-14(2,3)17(4,5)16-13-9-8-12-15(13)10-6-7-11-15/h8,12-13H,6-7,9-11H2,1-5H3/t13-/m1/s1.
What are the key properties of tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane?
tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane has a molecular weight of 252.47 g/mol, XLogP of 4.90, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(4R)-spiro[4.4]non-1-en-4-yl]oxysilane is sourced from PubChem (CID 54477997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).