cyclooctatetraenyl(triethoxy)silane

C14H22O3Si — CID 153307556

IUPACcyclooctatetraenyl(triethoxy)silane
SMILESCCO[Si](OCC)(OCC)C1=C/C=C\C=C/C=C\1
InChIInChI=1S/C14H22O3Si/c1-4-15-18(16-5-2,17-6-3)14-12-10-8-7-9-11-13-14/h7-13H,4-6H2,1-3H3/b8-7-,9-7-,10-8-,11-9-,12-10-,13-11-,14-12+,14-13+
InChIKeyCDEOTVDNFITVQJ-AVZMZKLYSA-N
MW266.41 g/mol
LogP3.18
Rot. Bonds7

About cyclooctatetraenyl(triethoxy)silane

cyclooctatetraenyl(triethoxy)silane (PubChem CID 153307556) has the molecular formula C14H22O3Si and a molecular weight of 266.41 g/mol. Its IUPAC name is cyclooctatetraenyl(triethoxy)silane.

Molecular Properties

Compound Namecyclooctatetraenyl(triethoxy)silane
PubChem CID153307556
Molecular FormulaC14H22O3Si
Molecular Weight266.41 g/mol
Exact Mass266.13
IUPAC Namecyclooctatetraenyl(triethoxy)silane
SMILESCCO[Si](OCC)(OCC)C1=C/C=C\C=C/C=C\1
InChIInChI=1S/C14H22O3Si/c1-4-15-18(16-5-2,17-6-3)14-12-10-8-7-9-11-13-14/h7-13H,4-6H2,1-3H3/b8-7-,9-7-,10-8-,11-9-,12-10-,13-11-,14-12+,14-13+
InChIKeyCDEOTVDNFITVQJ-AVZMZKLYSA-N
XLogP3.18
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 cyclooctatetraenyl(triethoxy)silane?
The IUPAC name of cyclooctatetraenyl(triethoxy)silane (CID 153307556) is cyclooctatetraenyl(triethoxy)silane.
What is the SMILES notation for cyclooctatetraenyl(triethoxy)silane?
The canonical SMILES for cyclooctatetraenyl(triethoxy)silane is CCO[Si](OCC)(OCC)C1=C/C=C\C=C/C=C\1.
What is the InChIKey of cyclooctatetraenyl(triethoxy)silane?
The InChIKey is CDEOTVDNFITVQJ-AVZMZKLYSA-N. The full InChI is InChI=1S/C14H22O3Si/c1-4-15-18(16-5-2,17-6-3)14-12-10-8-7-9-11-13-14/h7-13H,4-6H2,1-3H3/b8-7-,9-7-,10-8-,11-9-,12-10-,13-11-,14-12+,14-13+.
What are the key properties of cyclooctatetraenyl(triethoxy)silane?
cyclooctatetraenyl(triethoxy)silane has a molecular weight of 266.41 g/mol, XLogP of 3.18, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclooctatetraenyl(triethoxy)silane is sourced from PubChem (CID 153307556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).