ethoxy-oxo-(3-phenylprop-2-enoxy)silane

C11H14O3Si — CID 138395833

IUPACethoxy-oxo-(3-phenylprop-2-enoxy)silane
SMILESCCO[Si](=O)OCC=Cc1ccccc1
InChIInChI=1S/C11H14O3Si/c1-2-13-15(12)14-10-6-9-11-7-4-3-5-8-11/h3-9H,2,10H2,1H3
InChIKeyDFYOXWSOVRKGOG-UHFFFAOYSA-N
MW222.32 g/mol
LogP2.17
Rot. Bonds6

About ethoxy-oxo-(3-phenylprop-2-enoxy)silane

ethoxy-oxo-(3-phenylprop-2-enoxy)silane (PubChem CID 138395833) has the molecular formula C11H14O3Si and a molecular weight of 222.32 g/mol. Its IUPAC name is ethoxy-oxo-(3-phenylprop-2-enoxy)silane.

Molecular Properties

Compound Nameethoxy-oxo-(3-phenylprop-2-enoxy)silane
PubChem CID138395833
Molecular FormulaC11H14O3Si
Molecular Weight222.32 g/mol
Exact Mass222.07
IUPAC Nameethoxy-oxo-(3-phenylprop-2-enoxy)silane
SMILESCCO[Si](=O)OCC=Cc1ccccc1
InChIInChI=1S/C11H14O3Si/c1-2-13-15(12)14-10-6-9-11-7-4-3-5-8-11/h3-9H,2,10H2,1H3
InChIKeyDFYOXWSOVRKGOG-UHFFFAOYSA-N
XLogP2.17
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 52.17
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 ethoxy-oxo-(3-phenylprop-2-enoxy)silane?
The IUPAC name of ethoxy-oxo-(3-phenylprop-2-enoxy)silane (CID 138395833) is ethoxy-oxo-(3-phenylprop-2-enoxy)silane.
What is the SMILES notation for ethoxy-oxo-(3-phenylprop-2-enoxy)silane?
The canonical SMILES for ethoxy-oxo-(3-phenylprop-2-enoxy)silane is CCO[Si](=O)OCC=Cc1ccccc1.
What is the InChIKey of ethoxy-oxo-(3-phenylprop-2-enoxy)silane?
The InChIKey is DFYOXWSOVRKGOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3Si/c1-2-13-15(12)14-10-6-9-11-7-4-3-5-8-11/h3-9H,2,10H2,1H3.
What are the key properties of ethoxy-oxo-(3-phenylprop-2-enoxy)silane?
ethoxy-oxo-(3-phenylprop-2-enoxy)silane has a molecular weight of 222.32 g/mol, XLogP of 2.17, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-oxo-(3-phenylprop-2-enoxy)silane is sourced from PubChem (CID 138395833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).