diethoxymethyl(phenyl)silane

C11H18O2Si — CID 71431033

IUPACdiethoxymethyl(phenyl)silane
SMILESCCOC(OCC)[SiH2]c1ccccc1
InChIInChI=1S/C11H18O2Si/c1-3-12-11(13-4-2)14-10-8-6-5-7-9-10/h5-9,11H,3-4,14H2,1-2H3
InChIKeyMJQRNYJJBOGNSW-UHFFFAOYSA-N
MW210.35 g/mol
LogP0.84
Rot. Bonds6

About diethoxymethyl(phenyl)silane

diethoxymethyl(phenyl)silane (PubChem CID 71431033) has the molecular formula C11H18O2Si and a molecular weight of 210.35 g/mol. Its IUPAC name is diethoxymethyl(phenyl)silane.

Molecular Properties

Compound Namediethoxymethyl(phenyl)silane
PubChem CID71431033
Molecular FormulaC11H18O2Si
Molecular Weight210.35 g/mol
Exact Mass210.11
IUPAC Namediethoxymethyl(phenyl)silane
SMILESCCOC(OCC)[SiH2]c1ccccc1
InChIInChI=1S/C11H18O2Si/c1-3-12-11(13-4-2)14-10-8-6-5-7-9-10/h5-9,11H,3-4,14H2,1-2H3
InChIKeyMJQRNYJJBOGNSW-UHFFFAOYSA-N
XLogP0.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diethoxymethyl(phenyl)silane?
The IUPAC name of diethoxymethyl(phenyl)silane (CID 71431033) is diethoxymethyl(phenyl)silane.
What is the SMILES notation for diethoxymethyl(phenyl)silane?
The canonical SMILES for diethoxymethyl(phenyl)silane is CCOC(OCC)[SiH2]c1ccccc1.
What is the InChIKey of diethoxymethyl(phenyl)silane?
The InChIKey is MJQRNYJJBOGNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2Si/c1-3-12-11(13-4-2)14-10-8-6-5-7-9-10/h5-9,11H,3-4,14H2,1-2H3.
What are the key properties of diethoxymethyl(phenyl)silane?
diethoxymethyl(phenyl)silane has a molecular weight of 210.35 g/mol, XLogP of 0.84, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxymethyl(phenyl)silane is sourced from PubChem (CID 71431033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).