1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane

C8H18Cl4OSi2 — CID 91748233

IUPAC1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane
SMILESCC(Cl)[Si](C)(CCl)O[Si](C)(CCl)C(C)Cl
InChIInChI=1S/C8H18Cl4OSi2/c1-7(11)14(3,5-9)13-15(4,6-10)8(2)12/h7-8H,5-6H2,1-4H3
InChIKeyZKDXMTYJHZPVKV-UHFFFAOYSA-N
MW328.22 g/mol
LogP4.04
Rot. Bonds6

About 1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane

1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane (PubChem CID 91748233) has the molecular formula C8H18Cl4OSi2 and a molecular weight of 328.22 g/mol. Its IUPAC name is 1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane.

Molecular Properties

Compound Name1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane
PubChem CID91748233
Molecular FormulaC8H18Cl4OSi2
Molecular Weight328.22 g/mol
Exact Mass325.97
IUPAC Name1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane
SMILESCC(Cl)[Si](C)(CCl)O[Si](C)(CCl)C(C)Cl
InChIInChI=1S/C8H18Cl4OSi2/c1-7(11)14(3,5-9)13-15(4,6-10)8(2)12/h7-8H,5-6H2,1-4H3
InChIKeyZKDXMTYJHZPVKV-UHFFFAOYSA-N
XLogP4.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.22
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane?
The IUPAC name of 1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane (CID 91748233) is 1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane.
What is the SMILES notation for 1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane?
The canonical SMILES for 1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane is CC(Cl)[Si](C)(CCl)O[Si](C)(CCl)C(C)Cl.
What is the InChIKey of 1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane?
The InChIKey is ZKDXMTYJHZPVKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Cl4OSi2/c1-7(11)14(3,5-9)13-15(4,6-10)8(2)12/h7-8H,5-6H2,1-4H3.
What are the key properties of 1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane?
1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane has a molecular weight of 328.22 g/mol, XLogP of 4.04, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloroethyl-[1-chloroethyl-(chloromethyl)-methylsilyl]oxy-(chloromethyl)-methylsilane is sourced from PubChem (CID 91748233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).