[3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane

C14H28O2Si — CID 14202593

IUPAC[3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane
SMILESCC(C)(COC1=CCCCC1)CO[Si](C)(C)C
InChIInChI=1S/C14H28O2Si/c1-14(2,12-16-17(3,4)5)11-15-13-9-7-6-8-10-13/h9H,6-8,10-12H2,1-5H3
InChIKeyJKCPLBYZAWKIGA-UHFFFAOYSA-N
MW256.46 g/mol
LogP4.34
Rot. Bonds6

About [3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane

[3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane (PubChem CID 14202593) has the molecular formula C14H28O2Si and a molecular weight of 256.46 g/mol. Its IUPAC name is [3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane.

Molecular Properties

Compound Name[3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane
PubChem CID14202593
Molecular FormulaC14H28O2Si
Molecular Weight256.46 g/mol
Exact Mass256.19
IUPAC Name[3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane
SMILESCC(C)(COC1=CCCCC1)CO[Si](C)(C)C
InChIInChI=1S/C14H28O2Si/c1-14(2,12-16-17(3,4)5)11-15-13-9-7-6-8-10-13/h9H,6-8,10-12H2,1-5H3
InChIKeyJKCPLBYZAWKIGA-UHFFFAOYSA-N
XLogP4.34
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.46
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane?
The IUPAC name of [3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane (CID 14202593) is [3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane.
What is the SMILES notation for [3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane?
The canonical SMILES for [3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane is CC(C)(COC1=CCCCC1)CO[Si](C)(C)C.
What is the InChIKey of [3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane?
The InChIKey is JKCPLBYZAWKIGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2Si/c1-14(2,12-16-17(3,4)5)11-15-13-9-7-6-8-10-13/h9H,6-8,10-12H2,1-5H3.
What are the key properties of [3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane?
[3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane has a molecular weight of 256.46 g/mol, XLogP of 4.34, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(cyclohexen-1-yloxy)-2,2-dimethylpropoxy]-trimethylsilane is sourced from PubChem (CID 14202593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).