ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane

C12H28O3Si — CID 174637611

IUPACethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane
SMILESCCO[Si](CC)(CC)OC(C)(OC)C(C)C
InChIInChI=1S/C12H28O3Si/c1-8-14-16(9-2,10-3)15-12(6,13-7)11(4)5/h11H,8-10H2,1-7H3
InChIKeyFQYYHUICQIDGFH-UHFFFAOYSA-N
MW248.44 g/mol
LogP3.54
Rot. Bonds8

About ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane

ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane (PubChem CID 174637611) has the molecular formula C12H28O3Si and a molecular weight of 248.44 g/mol. Its IUPAC name is ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane.

Molecular Properties

Compound Nameethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane
PubChem CID174637611
Molecular FormulaC12H28O3Si
Molecular Weight248.44 g/mol
Exact Mass248.18
IUPAC Nameethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane
SMILESCCO[Si](CC)(CC)OC(C)(OC)C(C)C
InChIInChI=1S/C12H28O3Si/c1-8-14-16(9-2,10-3)15-12(6,13-7)11(4)5/h11H,8-10H2,1-7H3
InChIKeyFQYYHUICQIDGFH-UHFFFAOYSA-N
XLogP3.54
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.44
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane?
The IUPAC name of ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane (CID 174637611) is ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane.
What is the SMILES notation for ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane?
The canonical SMILES for ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane is CCO[Si](CC)(CC)OC(C)(OC)C(C)C.
What is the InChIKey of ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane?
The InChIKey is FQYYHUICQIDGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O3Si/c1-8-14-16(9-2,10-3)15-12(6,13-7)11(4)5/h11H,8-10H2,1-7H3.
What are the key properties of ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane?
ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane has a molecular weight of 248.44 g/mol, XLogP of 3.54, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-diethyl-(2-methoxy-3-methylbutan-2-yl)oxysilane is sourced from PubChem (CID 174637611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).