1,1,2-triethoxy-2-ethylsilinane

C13H28O3Si — CID 174278517

IUPAC1,1,2-triethoxy-2-ethylsilinane
SMILESCCOC1(CC)CCCC[Si]1(OCC)OCC
InChIInChI=1S/C13H28O3Si/c1-5-13(14-6-2)11-9-10-12-17(13,15-7-3)16-8-4/h5-12H2,1-4H3
InChIKeyKXXDVCCJCIDPGK-UHFFFAOYSA-N
MW260.45 g/mol
LogP3.41
Rot. Bonds7

About 1,1,2-triethoxy-2-ethylsilinane

1,1,2-triethoxy-2-ethylsilinane (PubChem CID 174278517) has the molecular formula C13H28O3Si and a molecular weight of 260.45 g/mol. Its IUPAC name is 1,1,2-triethoxy-2-ethylsilinane.

Molecular Properties

Compound Name1,1,2-triethoxy-2-ethylsilinane
PubChem CID174278517
Molecular FormulaC13H28O3Si
Molecular Weight260.45 g/mol
Exact Mass260.18
IUPAC Name1,1,2-triethoxy-2-ethylsilinane
SMILESCCOC1(CC)CCCC[Si]1(OCC)OCC
InChIInChI=1S/C13H28O3Si/c1-5-13(14-6-2)11-9-10-12-17(13,15-7-3)16-8-4/h5-12H2,1-4H3
InChIKeyKXXDVCCJCIDPGK-UHFFFAOYSA-N
XLogP3.41
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.45
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

Trimethoxy(oxan-2-yl)silane
CID 22012745
Methyl-octyl-(oxan-2-yl)silane
CID 123366447
Octyl(oxan-2-yl)silane
CID 123611603
Diethoxy(oxan-2-yl)silane
CID 123630751
Nonyl(oxan-2-yl)silane
CID 123720382
3-Fluoro-1,1,2-trimethoxy-2-propylsilinane
CID 174485939
1,1,2-Triethoxy-2-(3,3,3-trifluoropropyl)silinane
CID 174600475
1,1,2-Triethoxy-2-ethyl-3-fluorosilinane
CID 174856524
1,1,2-Triethoxy-3-fluoro-2-methylsilinane
CID 175241484
(6-Ethyloxan-2-yl)-trimethylsilane
CID 13214712
4-Methyl(pentamethylene)silyloxyoctane
CID 574962
Triethyl(oxan-4-yloxy)silane
CID 12172073

Frequently Asked Questions

What is the IUPAC name of 1,1,2-triethoxy-2-ethylsilinane?
The IUPAC name of 1,1,2-triethoxy-2-ethylsilinane (CID 174278517) is 1,1,2-triethoxy-2-ethylsilinane.
What is the SMILES notation for 1,1,2-triethoxy-2-ethylsilinane?
The canonical SMILES for 1,1,2-triethoxy-2-ethylsilinane is CCOC1(CC)CCCC[Si]1(OCC)OCC.
What is the InChIKey of 1,1,2-triethoxy-2-ethylsilinane?
The InChIKey is KXXDVCCJCIDPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O3Si/c1-5-13(14-6-2)11-9-10-12-17(13,15-7-3)16-8-4/h5-12H2,1-4H3.
What are the key properties of 1,1,2-triethoxy-2-ethylsilinane?
1,1,2-triethoxy-2-ethylsilinane has a molecular weight of 260.45 g/mol, XLogP of 3.41, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2-triethoxy-2-ethylsilinane is sourced from PubChem (CID 174278517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).