ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane

C6H13Cl3O2Si — CID 91711736

IUPACethoxy-dimethyl-(2,2,2-trichloroethoxy)silane
SMILESCCO[Si](C)(C)OCC(Cl)(Cl)Cl
InChIInChI=1S/C6H13Cl3O2Si/c1-4-10-12(2,3)11-5-6(7,8)9/h4-5H2,1-3H3
InChIKeyKUOBHDZOEWQKKK-UHFFFAOYSA-N
MW251.61 g/mol
LogP3.11
Rot. Bonds4

About ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane

ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane (PubChem CID 91711736) has the molecular formula C6H13Cl3O2Si and a molecular weight of 251.61 g/mol. Its IUPAC name is ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane.

Molecular Properties

Compound Nameethoxy-dimethyl-(2,2,2-trichloroethoxy)silane
PubChem CID91711736
Molecular FormulaC6H13Cl3O2Si
Molecular Weight251.61 g/mol
Exact Mass249.98
IUPAC Nameethoxy-dimethyl-(2,2,2-trichloroethoxy)silane
SMILESCCO[Si](C)(C)OCC(Cl)(Cl)Cl
InChIInChI=1S/C6H13Cl3O2Si/c1-4-10-12(2,3)11-5-6(7,8)9/h4-5H2,1-3H3
InChIKeyKUOBHDZOEWQKKK-UHFFFAOYSA-N
XLogP3.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.61
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane?
The IUPAC name of ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane (CID 91711736) is ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane.
What is the SMILES notation for ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane?
The canonical SMILES for ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane is CCO[Si](C)(C)OCC(Cl)(Cl)Cl.
What is the InChIKey of ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane?
The InChIKey is KUOBHDZOEWQKKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13Cl3O2Si/c1-4-10-12(2,3)11-5-6(7,8)9/h4-5H2,1-3H3.
What are the key properties of ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane?
ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane has a molecular weight of 251.61 g/mol, XLogP of 3.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-dimethyl-(2,2,2-trichloroethoxy)silane is sourced from PubChem (CID 91711736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).