chloromethyl-diethoxy-methoxysilane

C6H15ClO3Si — CID 22227250

IUPACchloromethyl-diethoxy-methoxysilane
SMILESCCO[Si](CCl)(OC)OCC
InChIInChI=1S/C6H15ClO3Si/c1-4-9-11(6-7,8-3)10-5-2/h4-6H2,1-3H3
InChIKeyRLXUGPRBDWIGRL-UHFFFAOYSA-N
MW198.72 g/mol
LogP1.42
Rot. Bonds6

About chloromethyl-diethoxy-methoxysilane

chloromethyl-diethoxy-methoxysilane (PubChem CID 22227250) has the molecular formula C6H15ClO3Si and a molecular weight of 198.72 g/mol. Its IUPAC name is chloromethyl-diethoxy-methoxysilane.

Molecular Properties

Compound Namechloromethyl-diethoxy-methoxysilane
PubChem CID22227250
Molecular FormulaC6H15ClO3Si
Molecular Weight198.72 g/mol
Exact Mass198.05
IUPAC Namechloromethyl-diethoxy-methoxysilane
SMILESCCO[Si](CCl)(OC)OCC
InChIInChI=1S/C6H15ClO3Si/c1-4-9-11(6-7,8-3)10-5-2/h4-6H2,1-3H3
InChIKeyRLXUGPRBDWIGRL-UHFFFAOYSA-N
XLogP1.42
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.72
LogP ≤ 51.42
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'}

Analyze chloromethyl-diethoxy-methoxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of chloromethyl-diethoxy-methoxysilane?
The IUPAC name of chloromethyl-diethoxy-methoxysilane (CID 22227250) is chloromethyl-diethoxy-methoxysilane.
What is the SMILES notation for chloromethyl-diethoxy-methoxysilane?
The canonical SMILES for chloromethyl-diethoxy-methoxysilane is CCO[Si](CCl)(OC)OCC.
What is the InChIKey of chloromethyl-diethoxy-methoxysilane?
The InChIKey is RLXUGPRBDWIGRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15ClO3Si/c1-4-9-11(6-7,8-3)10-5-2/h4-6H2,1-3H3.
What are the key properties of chloromethyl-diethoxy-methoxysilane?
chloromethyl-diethoxy-methoxysilane has a molecular weight of 198.72 g/mol, XLogP of 1.42, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl-diethoxy-methoxysilane is sourced from PubChem (CID 22227250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).