tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane

C13H26OSi — CID 11085508

IUPACtert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1CCC=CCC1
InChIInChI=1S/C13H26OSi/c1-13(2,3)15(4,5)14-12-10-8-6-7-9-11-12/h6-7,12H,8-11H2,1-5H3
InChIKeyUQLOAOWOJCZYQP-UHFFFAOYSA-N
MW226.44 g/mol
LogP4.51
Rot. Bonds2

About tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane

tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane (PubChem CID 11085508) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane
PubChem CID11085508
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Nametert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1CCC=CCC1
InChIInChI=1S/C13H26OSi/c1-13(2,3)15(4,5)14-12-10-8-6-7-9-11-12/h6-7,12H,8-11H2,1-5H3
InChIKeyUQLOAOWOJCZYQP-UHFFFAOYSA-N
XLogP4.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.51
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

tert-butyl-cycloundec-4-en-1-yloxy-dimethylsilane
CID 68818664
tert-butyl-[(5Z)-cycloundec-5-en-1-yl]oxy-dimethylsilane
CID 22177390
6-[tert-butyl(dimethyl)silyl]oxycyclodecan-1-ol
CID 11778782
tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane
CID 11021977
tert-butyl-(5-cyclopentylidenecyclooctyl)oxy-dimethylsilane
CID 10638575
tert-butyl-dimethyl-[[(1R,4S,8S)-9-oxabicyclo[6.1.0]nonan-4-yl]oxy]silane
CID 140674612
tert-butyl-dimethyl-(5-methylidenecyclooctyl)oxysilane
CID 11118631
[(4Z)-cyclooct-4-en-1-yl]oxy-trimethylsilane
CID 18541566
4-[tert-butyl(dimethyl)silyl]oxycycloheptan-1-one
CID 85308334
tert-butyl-dimethyl-(3-methylcyclohexyl)oxysilane
CID 14087160
cis-(1S,3R)-3-[tert-butyl(dimethyl)silyl]oxycyclohexan-1-ol
CID 14172793
tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane
CID 68820963

Frequently Asked Questions

What is the IUPAC name of tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane?
The IUPAC name of tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane (CID 11085508) is tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane.
What is the SMILES notation for tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane?
The canonical SMILES for tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane is CC(C)(C)[Si](C)(C)OC1CCC=CCC1.
What is the InChIKey of tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane?
The InChIKey is UQLOAOWOJCZYQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-13(2,3)15(4,5)14-12-10-8-6-7-9-11-12/h6-7,12H,8-11H2,1-5H3.
What are the key properties of tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane?
tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane has a molecular weight of 226.44 g/mol, XLogP of 4.51, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-cyclohept-4-en-1-yloxy-dimethylsilane is sourced from PubChem (CID 11085508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).