[cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane

C13H28O4Si — CID 151730406

IUPAC[cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane
SMILESCCOC(O[Si](CC)(OC)OC)C1CCCCC1
InChIInChI=1S/C13H28O4Si/c1-5-16-13(12-10-8-7-9-11-12)17-18(6-2,14-3)15-4/h12-13H,5-11H2,1-4H3
InChIKeyRKLBMSWHYICFSN-UHFFFAOYSA-N
MW276.45 g/mol
LogP3.20
Rot. Bonds8

About [cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane

[cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane (PubChem CID 151730406) has the molecular formula C13H28O4Si and a molecular weight of 276.45 g/mol. Its IUPAC name is [cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane.

Molecular Properties

Compound Name[cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane
PubChem CID151730406
Molecular FormulaC13H28O4Si
Molecular Weight276.45 g/mol
Exact Mass276.18
IUPAC Name[cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane
SMILESCCOC(O[Si](CC)(OC)OC)C1CCCCC1
InChIInChI=1S/C13H28O4Si/c1-5-16-13(12-10-8-7-9-11-12)17-18(6-2,14-3)15-4/h12-13H,5-11H2,1-4H3
InChIKeyRKLBMSWHYICFSN-UHFFFAOYSA-N
XLogP3.20
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.45
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane?
The IUPAC name of [cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane (CID 151730406) is [cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane.
What is the SMILES notation for [cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane?
The canonical SMILES for [cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane is CCOC(O[Si](CC)(OC)OC)C1CCCCC1.
What is the InChIKey of [cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane?
The InChIKey is RKLBMSWHYICFSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O4Si/c1-5-16-13(12-10-8-7-9-11-12)17-18(6-2,14-3)15-4/h12-13H,5-11H2,1-4H3.
What are the key properties of [cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane?
[cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane has a molecular weight of 276.45 g/mol, XLogP of 3.20, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane is sourced from PubChem (CID 151730406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).