tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane

C14H28OSi — CID 12568500

IUPACtert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1/C=C\CCCCC1
InChIInChI=1S/C14H28OSi/c1-14(2,3)16(4,5)15-13-11-9-7-6-8-10-12-13/h9,11,13H,6-8,10,12H2,1-5H3/b11-9-
InChIKeyRQFXLNCIDGJIGD-LUAWRHEFSA-N
MW240.46 g/mol
LogP4.90
Rot. Bonds2

About tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane

tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane (PubChem CID 12568500) has the molecular formula C14H28OSi and a molecular weight of 240.46 g/mol. Its IUPAC name is tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane
PubChem CID12568500
Molecular FormulaC14H28OSi
Molecular Weight240.46 g/mol
Exact Mass240.19
IUPAC Nametert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1/C=C\CCCCC1
InChIInChI=1S/C14H28OSi/c1-14(2,3)16(4,5)15-13-11-9-7-6-8-10-12-13/h9,11,13H,6-8,10,12H2,1-5H3/b11-9-
InChIKeyRQFXLNCIDGJIGD-LUAWRHEFSA-N
XLogP4.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.46
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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Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane (CID 12568500) is tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane is CC(C)(C)[Si](C)(C)OC1/C=C\CCCCC1.
What is the InChIKey of tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane?
The InChIKey is RQFXLNCIDGJIGD-LUAWRHEFSA-N. The full InChI is InChI=1S/C14H28OSi/c1-14(2,3)16(4,5)15-13-11-9-7-6-8-10-12-13/h9,11,13H,6-8,10,12H2,1-5H3/b11-9-.
What are the key properties of tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane?
tert-butyl-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane has a molecular weight of 240.46 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-[(2Z)-cyclooct-2-en-1-yl]oxy-dimethylsilane is sourced from PubChem (CID 12568500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).