oxolan-2-ylmethoxy-diphenyl-propoxysilane

C20H26O3Si — CID 91739748

IUPACoxolan-2-ylmethoxy-diphenyl-propoxysilane
SMILESCCCO[Si](OCC1CCCO1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H26O3Si/c1-2-15-22-24(19-11-5-3-6-12-19,20-13-7-4-8-14-20)23-17-18-10-9-16-21-18/h3-8,11-14,18H,2,9-10,15-17H2,1H3
InChIKeyFYZQQGVOCICEDS-UHFFFAOYSA-N
MW342.51 g/mol
LogP2.87
Rot. Bonds8

About oxolan-2-ylmethoxy-diphenyl-propoxysilane

oxolan-2-ylmethoxy-diphenyl-propoxysilane (PubChem CID 91739748) has the molecular formula C20H26O3Si and a molecular weight of 342.51 g/mol. Its IUPAC name is oxolan-2-ylmethoxy-diphenyl-propoxysilane.

Molecular Properties

Compound Nameoxolan-2-ylmethoxy-diphenyl-propoxysilane
PubChem CID91739748
Molecular FormulaC20H26O3Si
Molecular Weight342.51 g/mol
Exact Mass342.17
IUPAC Nameoxolan-2-ylmethoxy-diphenyl-propoxysilane
SMILESCCCO[Si](OCC1CCCO1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H26O3Si/c1-2-15-22-24(19-11-5-3-6-12-19,20-13-7-4-8-14-20)23-17-18-10-9-16-21-18/h3-8,11-14,18H,2,9-10,15-17H2,1H3
InChIKeyFYZQQGVOCICEDS-UHFFFAOYSA-N
XLogP2.87
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.51
LogP ≤ 52.87
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 oxolan-2-ylmethoxy-diphenyl-propoxysilane?
The IUPAC name of oxolan-2-ylmethoxy-diphenyl-propoxysilane (CID 91739748) is oxolan-2-ylmethoxy-diphenyl-propoxysilane.
What is the SMILES notation for oxolan-2-ylmethoxy-diphenyl-propoxysilane?
The canonical SMILES for oxolan-2-ylmethoxy-diphenyl-propoxysilane is CCCO[Si](OCC1CCCO1)(c1ccccc1)c1ccccc1.
What is the InChIKey of oxolan-2-ylmethoxy-diphenyl-propoxysilane?
The InChIKey is FYZQQGVOCICEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26O3Si/c1-2-15-22-24(19-11-5-3-6-12-19,20-13-7-4-8-14-20)23-17-18-10-9-16-21-18/h3-8,11-14,18H,2,9-10,15-17H2,1H3.
What are the key properties of oxolan-2-ylmethoxy-diphenyl-propoxysilane?
oxolan-2-ylmethoxy-diphenyl-propoxysilane has a molecular weight of 342.51 g/mol, XLogP of 2.87, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-2-ylmethoxy-diphenyl-propoxysilane is sourced from PubChem (CID 91739748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).