2-butyl-1,1,2-triethoxysilinane

C15H32O3Si — CID 174337464

IUPAC2-butyl-1,1,2-triethoxysilinane
SMILESCCCCC1(OCC)CCCC[Si]1(OCC)OCC
InChIInChI=1S/C15H32O3Si/c1-5-9-12-15(16-6-2)13-10-11-14-19(15,17-7-3)18-8-4/h5-14H2,1-4H3
InChIKeyGYNJWBQFQRRGJZ-UHFFFAOYSA-N
MW288.50 g/mol
LogP4.19
Rot. Bonds9

About 2-butyl-1,1,2-triethoxysilinane

2-butyl-1,1,2-triethoxysilinane (PubChem CID 174337464) has the molecular formula C15H32O3Si and a molecular weight of 288.50 g/mol. Its IUPAC name is 2-butyl-1,1,2-triethoxysilinane.

Molecular Properties

Compound Name2-butyl-1,1,2-triethoxysilinane
PubChem CID174337464
Molecular FormulaC15H32O3Si
Molecular Weight288.50 g/mol
Exact Mass288.21
IUPAC Name2-butyl-1,1,2-triethoxysilinane
SMILESCCCCC1(OCC)CCCC[Si]1(OCC)OCC
InChIInChI=1S/C15H32O3Si/c1-5-9-12-15(16-6-2)13-10-11-14-19(15,17-7-3)18-8-4/h5-14H2,1-4H3
InChIKeyGYNJWBQFQRRGJZ-UHFFFAOYSA-N
XLogP4.19
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.50
LogP ≤ 54.19
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 2-butyl-1,1,2-triethoxysilinane?
The IUPAC name of 2-butyl-1,1,2-triethoxysilinane (CID 174337464) is 2-butyl-1,1,2-triethoxysilinane.
What is the SMILES notation for 2-butyl-1,1,2-triethoxysilinane?
The canonical SMILES for 2-butyl-1,1,2-triethoxysilinane is CCCCC1(OCC)CCCC[Si]1(OCC)OCC.
What is the InChIKey of 2-butyl-1,1,2-triethoxysilinane?
The InChIKey is GYNJWBQFQRRGJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O3Si/c1-5-9-12-15(16-6-2)13-10-11-14-19(15,17-7-3)18-8-4/h5-14H2,1-4H3.
What are the key properties of 2-butyl-1,1,2-triethoxysilinane?
2-butyl-1,1,2-triethoxysilinane has a molecular weight of 288.50 g/mol, XLogP of 4.19, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-1,1,2-triethoxysilinane is sourced from PubChem (CID 174337464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).