2-cyclopropyl-1,1,2-triethoxysilinane

C14H28O3Si — CID 174341764

IUPAC2-cyclopropyl-1,1,2-triethoxysilinane
SMILESCCOC1(C2CC2)CCCC[Si]1(OCC)OCC
InChIInChI=1S/C14H28O3Si/c1-4-15-14(13-9-10-13)11-7-8-12-18(14,16-5-2)17-6-3/h13H,4-12H2,1-3H3
InChIKeySSAXWCKTVHBZCX-UHFFFAOYSA-N
MW272.46 g/mol
LogP3.41
Rot. Bonds7

About 2-cyclopropyl-1,1,2-triethoxysilinane

2-cyclopropyl-1,1,2-triethoxysilinane (PubChem CID 174341764) has the molecular formula C14H28O3Si and a molecular weight of 272.46 g/mol. Its IUPAC name is 2-cyclopropyl-1,1,2-triethoxysilinane.

Molecular Properties

Compound Name2-cyclopropyl-1,1,2-triethoxysilinane
PubChem CID174341764
Molecular FormulaC14H28O3Si
Molecular Weight272.46 g/mol
Exact Mass272.18
IUPAC Name2-cyclopropyl-1,1,2-triethoxysilinane
SMILESCCOC1(C2CC2)CCCC[Si]1(OCC)OCC
InChIInChI=1S/C14H28O3Si/c1-4-15-14(13-9-10-13)11-7-8-12-18(14,16-5-2)17-6-3/h13H,4-12H2,1-3H3
InChIKeySSAXWCKTVHBZCX-UHFFFAOYSA-N
XLogP3.41
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
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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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1,1,2-triethoxysilinane?
The IUPAC name of 2-cyclopropyl-1,1,2-triethoxysilinane (CID 174341764) is 2-cyclopropyl-1,1,2-triethoxysilinane.
What is the SMILES notation for 2-cyclopropyl-1,1,2-triethoxysilinane?
The canonical SMILES for 2-cyclopropyl-1,1,2-triethoxysilinane is CCOC1(C2CC2)CCCC[Si]1(OCC)OCC.
What is the InChIKey of 2-cyclopropyl-1,1,2-triethoxysilinane?
The InChIKey is SSAXWCKTVHBZCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O3Si/c1-4-15-14(13-9-10-13)11-7-8-12-18(14,16-5-2)17-6-3/h13H,4-12H2,1-3H3.
What are the key properties of 2-cyclopropyl-1,1,2-triethoxysilinane?
2-cyclopropyl-1,1,2-triethoxysilinane has a molecular weight of 272.46 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 2-cyclopropyl-1,1,2-triethoxysilinane is sourced from PubChem (CID 174341764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).