1,1-dichloroethoxysilane

C2H6Cl2OSi — CID 123382571

IUPAC1,1-dichloroethoxysilane
SMILESCC(Cl)(Cl)O[SiH3]
InChIInChI=1S/C2H6Cl2OSi/c1-2(3,4)5-6/h1,6H3
InChIKeyRKESDXFLHHSJRI-UHFFFAOYSA-N
MW145.06 g/mol
LogP0.43
Rot. Bonds1

About 1,1-dichloroethoxysilane

1,1-dichloroethoxysilane (PubChem CID 123382571) has the molecular formula C2H6Cl2OSi and a molecular weight of 145.06 g/mol. Its IUPAC name is 1,1-dichloroethoxysilane.

Molecular Properties

Compound Name1,1-dichloroethoxysilane
PubChem CID123382571
Molecular FormulaC2H6Cl2OSi
Molecular Weight145.06 g/mol
Exact Mass143.96
IUPAC Name1,1-dichloroethoxysilane
SMILESCC(Cl)(Cl)O[SiH3]
InChIInChI=1S/C2H6Cl2OSi/c1-2(3,4)5-6/h1,6H3
InChIKeyRKESDXFLHHSJRI-UHFFFAOYSA-N
XLogP0.43
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.06
LogP ≤ 50.43
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 1,1-dichloroethoxysilane?
The IUPAC name of 1,1-dichloroethoxysilane (CID 123382571) is 1,1-dichloroethoxysilane.
What is the SMILES notation for 1,1-dichloroethoxysilane?
The canonical SMILES for 1,1-dichloroethoxysilane is CC(Cl)(Cl)O[SiH3].
What is the InChIKey of 1,1-dichloroethoxysilane?
The InChIKey is RKESDXFLHHSJRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6Cl2OSi/c1-2(3,4)5-6/h1,6H3.
What are the key properties of 1,1-dichloroethoxysilane?
1,1-dichloroethoxysilane has a molecular weight of 145.06 g/mol, XLogP of 0.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dichloroethoxysilane is sourced from PubChem (CID 123382571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).