cyclooctatetraenyl(tripropoxy)silane

C17H28O3Si — CID 154404138

IUPACcyclooctatetraenyl(tripropoxy)silane
SMILESCCCO[Si](OCCC)(OCCC)C1=CC=CC=CC=C1
InChIInChI=1S/C17H28O3Si/c1-4-14-18-21(19-15-5-2,20-16-6-3)17-12-10-8-7-9-11-13-17/h7-13H,4-6,14-16H2,1-3H3
InChIKeyJKIJASRZDPNEHN-UHFFFAOYSA-N
MW308.49 g/mol
LogP4.35
Rot. Bonds10

About cyclooctatetraenyl(tripropoxy)silane

cyclooctatetraenyl(tripropoxy)silane (PubChem CID 154404138) has the molecular formula C17H28O3Si and a molecular weight of 308.49 g/mol. Its IUPAC name is cyclooctatetraenyl(tripropoxy)silane.

Molecular Properties

Compound Namecyclooctatetraenyl(tripropoxy)silane
PubChem CID154404138
Molecular FormulaC17H28O3Si
Molecular Weight308.49 g/mol
Exact Mass308.18
IUPAC Namecyclooctatetraenyl(tripropoxy)silane
SMILESCCCO[Si](OCCC)(OCCC)C1=CC=CC=CC=C1
InChIInChI=1S/C17H28O3Si/c1-4-14-18-21(19-15-5-2,20-16-6-3)17-12-10-8-7-9-11-13-17/h7-13H,4-6,14-16H2,1-3H3
InChIKeyJKIJASRZDPNEHN-UHFFFAOYSA-N
XLogP4.35
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.49
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

cyclooctatetraenyl(triethoxy)silane
CID 153307556
4-tripropoxysilylphenol
CID 141199988
(5-methylcyclopenta-1,4-dien-1-yl)-tripropoxysilane
CID 87079231
ethane;1-propoxycyclohepta-1,3,5-triene
CID 142183410
CID 142048626
CID 142048626
(2,3-diiodophenyl)-tripropoxysilane
CID 153491478
[diphenyl(propoxy)silyl]-diphenyl-propoxysilane
CID 4983339
methoxy-naphthalen-1-yl-dipropoxysilane
CID 140892673
dipentyl dipropyl silicate
CID 524722
methyl(tripropoxy)silane;hydrate
CID 172826593
(2-chlorophenoxy)-ethenyl-methyl-propoxysilane
CID 91737847
ethenyl-(iodomethyl)-dipropoxysilane
CID 23146541

Frequently Asked Questions

What is the IUPAC name of cyclooctatetraenyl(tripropoxy)silane?
The IUPAC name of cyclooctatetraenyl(tripropoxy)silane (CID 154404138) is cyclooctatetraenyl(tripropoxy)silane.
What is the SMILES notation for cyclooctatetraenyl(tripropoxy)silane?
The canonical SMILES for cyclooctatetraenyl(tripropoxy)silane is CCCO[Si](OCCC)(OCCC)C1=CC=CC=CC=C1.
What is the InChIKey of cyclooctatetraenyl(tripropoxy)silane?
The InChIKey is JKIJASRZDPNEHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28O3Si/c1-4-14-18-21(19-15-5-2,20-16-6-3)17-12-10-8-7-9-11-13-17/h7-13H,4-6,14-16H2,1-3H3.
What are the key properties of cyclooctatetraenyl(tripropoxy)silane?
cyclooctatetraenyl(tripropoxy)silane has a molecular weight of 308.49 g/mol, XLogP of 4.35, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclooctatetraenyl(tripropoxy)silane is sourced from PubChem (CID 154404138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).