triethoxy(phenyl)silane

C12H20O3Si — CID 13075

IUPACtriethoxy(phenyl)silane
SMILESCCO[Si](OCC)(OCC)c1ccccc1
InChIInChI=1S/C12H20O3Si/c1-4-13-16(14-5-2,15-6-3)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3
InChIKeyJCVQKRGIASEUKR-UHFFFAOYSA-N
MW240.37 g/mol
LogP1.94
Rot. Bonds7

About triethoxy(phenyl)silane

triethoxy(phenyl)silane (PubChem CID 13075) has the molecular formula C12H20O3Si and a molecular weight of 240.37 g/mol. Its IUPAC name is triethoxy(phenyl)silane.

Molecular Properties

Compound Nametriethoxy(phenyl)silane
PubChem CID13075
Molecular FormulaC12H20O3Si
Molecular Weight240.37 g/mol
Exact Mass240.12
IUPAC Nametriethoxy(phenyl)silane
SMILESCCO[Si](OCC)(OCC)c1ccccc1
InChIInChI=1S/C12H20O3Si/c1-4-13-16(14-5-2,15-6-3)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3
InChIKeyJCVQKRGIASEUKR-UHFFFAOYSA-N
XLogP1.94
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 51.94
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 triethoxy(phenyl)silane?
The IUPAC name of triethoxy(phenyl)silane (CID 13075) is triethoxy(phenyl)silane.
What is the SMILES notation for triethoxy(phenyl)silane?
The canonical SMILES for triethoxy(phenyl)silane is CCO[Si](OCC)(OCC)c1ccccc1.
What is the InChIKey of triethoxy(phenyl)silane?
The InChIKey is JCVQKRGIASEUKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O3Si/c1-4-13-16(14-5-2,15-6-3)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3.
What are the key properties of triethoxy(phenyl)silane?
triethoxy(phenyl)silane has a molecular weight of 240.37 g/mol, XLogP of 1.94, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(phenyl)silane is sourced from PubChem (CID 13075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).