chloro-(chloromethyl)-ethoxysilane

C3H8Cl2OSi — CID 175387793

IUPACchloro-(chloromethyl)-ethoxysilane
SMILESCCO[SiH](Cl)CCl
InChIInChI=1S/C3H8Cl2OSi/c1-2-6-7(5)3-4/h7H,2-3H2,1H3
InChIKeyBXUZPSSSZONOKX-UHFFFAOYSA-N
MW159.09 g/mol
LogP1.26
Rot. Bonds3

About chloro-(chloromethyl)-ethoxysilane

chloro-(chloromethyl)-ethoxysilane (PubChem CID 175387793) has the molecular formula C3H8Cl2OSi and a molecular weight of 159.09 g/mol. Its IUPAC name is chloro-(chloromethyl)-ethoxysilane.

Molecular Properties

Compound Namechloro-(chloromethyl)-ethoxysilane
PubChem CID175387793
Molecular FormulaC3H8Cl2OSi
Molecular Weight159.09 g/mol
Exact Mass157.97
IUPAC Namechloro-(chloromethyl)-ethoxysilane
SMILESCCO[SiH](Cl)CCl
InChIInChI=1S/C3H8Cl2OSi/c1-2-6-7(5)3-4/h7H,2-3H2,1H3
InChIKeyBXUZPSSSZONOKX-UHFFFAOYSA-N
XLogP1.26
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.09
LogP ≤ 51.26
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'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of chloro-(chloromethyl)-ethoxysilane?
The IUPAC name of chloro-(chloromethyl)-ethoxysilane (CID 175387793) is chloro-(chloromethyl)-ethoxysilane.
What is the SMILES notation for chloro-(chloromethyl)-ethoxysilane?
The canonical SMILES for chloro-(chloromethyl)-ethoxysilane is CCO[SiH](Cl)CCl.
What is the InChIKey of chloro-(chloromethyl)-ethoxysilane?
The InChIKey is BXUZPSSSZONOKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8Cl2OSi/c1-2-6-7(5)3-4/h7H,2-3H2,1H3.
What are the key properties of chloro-(chloromethyl)-ethoxysilane?
chloro-(chloromethyl)-ethoxysilane has a molecular weight of 159.09 g/mol, XLogP of 1.26, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(chloromethyl)-ethoxysilane is sourced from PubChem (CID 175387793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).