tris(1-chloroethoxy)silane

C6H13Cl3O3Si — CID 162126576

IUPACtris(1-chloroethoxy)silane
SMILESCC(Cl)O[SiH](OC(C)Cl)OC(C)Cl
InChIInChI=1S/C6H13Cl3O3Si/c1-4(7)10-13(11-5(2)8)12-6(3)9/h4-6,13H,1-3H3
InChIKeyZICOBVLXXDDEBX-UHFFFAOYSA-N
MW267.61 g/mol
LogP2.51
Rot. Bonds6

About tris(1-chloroethoxy)silane

tris(1-chloroethoxy)silane (PubChem CID 162126576) has the molecular formula C6H13Cl3O3Si and a molecular weight of 267.61 g/mol. Its IUPAC name is tris(1-chloroethoxy)silane.

Molecular Properties

Compound Nametris(1-chloroethoxy)silane
PubChem CID162126576
Molecular FormulaC6H13Cl3O3Si
Molecular Weight267.61 g/mol
Exact Mass265.97
IUPAC Nametris(1-chloroethoxy)silane
SMILESCC(Cl)O[SiH](OC(C)Cl)OC(C)Cl
InChIInChI=1S/C6H13Cl3O3Si/c1-4(7)10-13(11-5(2)8)12-6(3)9/h4-6,13H,1-3H3
InChIKeyZICOBVLXXDDEBX-UHFFFAOYSA-N
XLogP2.51
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.61
LogP ≤ 52.51
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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Related Compounds

Silane, tris(2-chloroethoxy)-
CID 6328155
CID 24993
CID 24993
Bis(2-chloroethoxy)-methylsilane
CID 87472
3-Chloromethyltrimethoxysilane
CID 88788085
Bis(2-chloroethoxy)-oxosilane
CID 53690555
Bis(1-chloroethoxy)silane
CID 123183734
Bis(2-chloroethoxy)-ethylsilane
CID 123393354
Tris(2-chloropropoxy)silane
CID 123451578
Bis(1-chloropropoxy)silane
CID 123696543
Tris(1-chloropropoxy)silane
CID 123979185
3-Chloropropoxy(propoxy)silane
CID 154510497
CID 156732892
CID 156732892

Frequently Asked Questions

What is the IUPAC name of tris(1-chloroethoxy)silane?
The IUPAC name of tris(1-chloroethoxy)silane (CID 162126576) is tris(1-chloroethoxy)silane.
What is the SMILES notation for tris(1-chloroethoxy)silane?
The canonical SMILES for tris(1-chloroethoxy)silane is CC(Cl)O[SiH](OC(C)Cl)OC(C)Cl.
What is the InChIKey of tris(1-chloroethoxy)silane?
The InChIKey is ZICOBVLXXDDEBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13Cl3O3Si/c1-4(7)10-13(11-5(2)8)12-6(3)9/h4-6,13H,1-3H3.
What are the key properties of tris(1-chloroethoxy)silane?
tris(1-chloroethoxy)silane has a molecular weight of 267.61 g/mol, XLogP of 2.51, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tris(1-chloroethoxy)silane is sourced from PubChem (CID 162126576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).