(4-ethenylphenyl)methoxy-ethyl-dimethoxysilane

C13H20O3Si — CID 154075115

IUPAC(4-ethenylphenyl)methoxy-ethyl-dimethoxysilane
SMILESC=Cc1ccc(CO[Si](CC)(OC)OC)cc1
InChIInChI=1S/C13H20O3Si/c1-5-12-7-9-13(10-8-12)11-16-17(6-2,14-3)15-4/h5,7-10H,1,6,11H2,2-4H3
InChIKeyQTSJBGBDBKEDLS-UHFFFAOYSA-N
MW252.39 g/mol
LogP3.10
Rot. Bonds7

About (4-ethenylphenyl)methoxy-ethyl-dimethoxysilane

(4-ethenylphenyl)methoxy-ethyl-dimethoxysilane (PubChem CID 154075115) has the molecular formula C13H20O3Si and a molecular weight of 252.39 g/mol. Its IUPAC name is (4-ethenylphenyl)methoxy-ethyl-dimethoxysilane.

Molecular Properties

Compound Name(4-ethenylphenyl)methoxy-ethyl-dimethoxysilane
PubChem CID154075115
Molecular FormulaC13H20O3Si
Molecular Weight252.39 g/mol
Exact Mass252.12
IUPAC Name(4-ethenylphenyl)methoxy-ethyl-dimethoxysilane
SMILESC=Cc1ccc(CO[Si](CC)(OC)OC)cc1
InChIInChI=1S/C13H20O3Si/c1-5-12-7-9-13(10-8-12)11-16-17(6-2,14-3)15-4/h5,7-10H,1,6,11H2,2-4H3
InChIKeyQTSJBGBDBKEDLS-UHFFFAOYSA-N
XLogP3.10
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.39
LogP ≤ 53.10
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 (4-ethenylphenyl)methoxy-ethyl-dimethoxysilane?
The IUPAC name of (4-ethenylphenyl)methoxy-ethyl-dimethoxysilane (CID 154075115) is (4-ethenylphenyl)methoxy-ethyl-dimethoxysilane.
What is the SMILES notation for (4-ethenylphenyl)methoxy-ethyl-dimethoxysilane?
The canonical SMILES for (4-ethenylphenyl)methoxy-ethyl-dimethoxysilane is C=Cc1ccc(CO[Si](CC)(OC)OC)cc1.
What is the InChIKey of (4-ethenylphenyl)methoxy-ethyl-dimethoxysilane?
The InChIKey is QTSJBGBDBKEDLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O3Si/c1-5-12-7-9-13(10-8-12)11-16-17(6-2,14-3)15-4/h5,7-10H,1,6,11H2,2-4H3.
What are the key properties of (4-ethenylphenyl)methoxy-ethyl-dimethoxysilane?
(4-ethenylphenyl)methoxy-ethyl-dimethoxysilane has a molecular weight of 252.39 g/mol, XLogP of 3.10, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethenylphenyl)methoxy-ethyl-dimethoxysilane is sourced from PubChem (CID 154075115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).