tris(2-chloroethoxy)silane

C6H13Cl3O3Si — CID 24993

IUPACtris(2-chloroethoxy)silane
SMILESClCCO[SiH](OCCCl)OCCCl
InChIInChI=1S/C6H13Cl3O3Si/c7-1-4-10-13(11-5-2-8)12-6-3-9/h13H,1-6H2
InChIKeyGSDMVIWNWCWYFB-UHFFFAOYSA-N
MW267.61 g/mol
LogP1.47
Rot. Bonds9

About tris(2-chloroethoxy)silane

tris(2-chloroethoxy)silane (PubChem CID 24993) has the molecular formula C6H13Cl3O3Si and a molecular weight of 267.61 g/mol. Its IUPAC name is tris(2-chloroethoxy)silane.

Molecular Properties

Compound Nametris(2-chloroethoxy)silane
PubChem CID24993
Molecular FormulaC6H13Cl3O3Si
Molecular Weight267.61 g/mol
Exact Mass265.97
IUPAC Nametris(2-chloroethoxy)silane
SMILESClCCO[SiH](OCCCl)OCCCl
InChIInChI=1S/C6H13Cl3O3Si/c7-1-4-10-13(11-5-2-8)12-6-3-9/h13H,1-6H2
InChIKeyGSDMVIWNWCWYFB-UHFFFAOYSA-N
XLogP1.47
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.61
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tris(2-chloroethoxy)silane?
The IUPAC name of tris(2-chloroethoxy)silane (CID 24993) is tris(2-chloroethoxy)silane.
What is the SMILES notation for tris(2-chloroethoxy)silane?
The canonical SMILES for tris(2-chloroethoxy)silane is ClCCO[SiH](OCCCl)OCCCl.
What is the InChIKey of tris(2-chloroethoxy)silane?
The InChIKey is GSDMVIWNWCWYFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13Cl3O3Si/c7-1-4-10-13(11-5-2-8)12-6-3-9/h13H,1-6H2.
What are the key properties of tris(2-chloroethoxy)silane?
tris(2-chloroethoxy)silane has a molecular weight of 267.61 g/mol, XLogP of 1.47, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-chloroethoxy)silane is sourced from PubChem (CID 24993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).