tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane

C16H32OSi — CID 68820963

IUPACtert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1C=CCCCCCCC1
InChIInChI=1S/C16H32OSi/c1-16(2,3)18(4,5)17-15-13-11-9-7-6-8-10-12-14-15/h11,13,15H,6-10,12,14H2,1-5H3
InChIKeyNBTSPIZKJITDHH-UHFFFAOYSA-N
MW268.52 g/mol
LogP5.68
Rot. Bonds2

About tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane

tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane (PubChem CID 68820963) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane
PubChem CID68820963
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Nametert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1C=CCCCCCCC1
InChIInChI=1S/C16H32OSi/c1-16(2,3)18(4,5)17-15-13-11-9-7-6-8-10-12-14-15/h11,13,15H,6-10,12,14H2,1-5H3
InChIKeyNBTSPIZKJITDHH-UHFFFAOYSA-N
XLogP5.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.68
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-cyclodec-2-en-1-yloxy-dimethylsilane?
The IUPAC name of tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane (CID 68820963) is tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane.
What is the SMILES notation for tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane?
The canonical SMILES for tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane is CC(C)(C)[Si](C)(C)OC1C=CCCCCCCC1.
What is the InChIKey of tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane?
The InChIKey is NBTSPIZKJITDHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-16(2,3)18(4,5)17-15-13-11-9-7-6-8-10-12-14-15/h11,13,15H,6-10,12,14H2,1-5H3.
What are the key properties of tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane?
tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane has a molecular weight of 268.52 g/mol, XLogP of 5.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-cyclodec-2-en-1-yloxy-dimethylsilane is sourced from PubChem (CID 68820963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).