2-(dichloromethylsilyl)ethyl-trimethoxysilane

C6H16Cl2O3Si2 — CID 71346329

IUPAC2-(dichloromethylsilyl)ethyl-trimethoxysilane
SMILESCO[Si](CC[SiH2]C(Cl)Cl)(OC)OC
InChIInChI=1S/C6H16Cl2O3Si2/c1-9-13(10-2,11-3)5-4-12-6(7)8/h6H,4-5,12H2,1-3H3
InChIKeyHKEVQYLWEVBYSX-UHFFFAOYSA-N
MW263.27 g/mol
LogP1.21
Rot. Bonds7

About 2-(dichloromethylsilyl)ethyl-trimethoxysilane

2-(dichloromethylsilyl)ethyl-trimethoxysilane (PubChem CID 71346329) has the molecular formula C6H16Cl2O3Si2 and a molecular weight of 263.27 g/mol. Its IUPAC name is 2-(dichloromethylsilyl)ethyl-trimethoxysilane.

Molecular Properties

Compound Name2-(dichloromethylsilyl)ethyl-trimethoxysilane
PubChem CID71346329
Molecular FormulaC6H16Cl2O3Si2
Molecular Weight263.27 g/mol
Exact Mass262.00
IUPAC Name2-(dichloromethylsilyl)ethyl-trimethoxysilane
SMILESCO[Si](CC[SiH2]C(Cl)Cl)(OC)OC
InChIInChI=1S/C6H16Cl2O3Si2/c1-9-13(10-2,11-3)5-4-12-6(7)8/h6H,4-5,12H2,1-3H3
InChIKeyHKEVQYLWEVBYSX-UHFFFAOYSA-N
XLogP1.21
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.27
LogP ≤ 51.21
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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Frequently Asked Questions

What is the IUPAC name of 2-(dichloromethylsilyl)ethyl-trimethoxysilane?
The IUPAC name of 2-(dichloromethylsilyl)ethyl-trimethoxysilane (CID 71346329) is 2-(dichloromethylsilyl)ethyl-trimethoxysilane.
What is the SMILES notation for 2-(dichloromethylsilyl)ethyl-trimethoxysilane?
The canonical SMILES for 2-(dichloromethylsilyl)ethyl-trimethoxysilane is CO[Si](CC[SiH2]C(Cl)Cl)(OC)OC.
What is the InChIKey of 2-(dichloromethylsilyl)ethyl-trimethoxysilane?
The InChIKey is HKEVQYLWEVBYSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16Cl2O3Si2/c1-9-13(10-2,11-3)5-4-12-6(7)8/h6H,4-5,12H2,1-3H3.
What are the key properties of 2-(dichloromethylsilyl)ethyl-trimethoxysilane?
2-(dichloromethylsilyl)ethyl-trimethoxysilane has a molecular weight of 263.27 g/mol, XLogP of 1.21, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dichloromethylsilyl)ethyl-trimethoxysilane is sourced from PubChem (CID 71346329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).