chloromethyl-diethoxy-methylsilane

C6H15ClO2Si — CID 16650

IUPACchloromethyl-diethoxy-methylsilane
SMILESCCO[Si](C)(CCl)OCC
InChIInChI=1S/C6H15ClO2Si/c1-4-8-10(3,6-7)9-5-2/h4-6H2,1-3H3
InChIKeyXGLLBUISUZEUMW-UHFFFAOYSA-N
MW182.72 g/mol
LogP1.91
Rot. Bonds5

About chloromethyl-diethoxy-methylsilane

chloromethyl-diethoxy-methylsilane (PubChem CID 16650) has the molecular formula C6H15ClO2Si and a molecular weight of 182.72 g/mol. Its IUPAC name is chloromethyl-diethoxy-methylsilane.

Molecular Properties

Compound Namechloromethyl-diethoxy-methylsilane
PubChem CID16650
Molecular FormulaC6H15ClO2Si
Molecular Weight182.72 g/mol
Exact Mass182.05
IUPAC Namechloromethyl-diethoxy-methylsilane
SMILESCCO[Si](C)(CCl)OCC
InChIInChI=1S/C6H15ClO2Si/c1-4-8-10(3,6-7)9-5-2/h4-6H2,1-3H3
InChIKeyXGLLBUISUZEUMW-UHFFFAOYSA-N
XLogP1.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.72
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(Chloromethyl)ethoxydimethylsilane
CID 26073
Silane, (chloromethyl)triethoxy-
CID 84858
Methylchloromethylethoxychlorosilane
CID 13827878
Chloromethyldiethoxysilane
CID 14475751
Chloro(chloromethyl)diethoxysilane
CID 22227254
Chloro-methylmethyldiethoxysilane
CID 87181296
(Chloromethyl)(dimethyl)propoxysilane
CID 266136
Silane, chloromethyl, methyl, dipropoxy
CID 23146659
Silane, (chloromethyl)methylbis(vinyloxy)-
CID 129771869
a-Chloromethylmethylethoxysilane
CID 129803964
Silane, chloromethyl, ethyl, ethoxy, methyl
CID 55302261
1-Chloroethoxy(trimethyl)silane
CID 13383779

Frequently Asked Questions

What is the IUPAC name of chloromethyl-diethoxy-methylsilane?
The IUPAC name of chloromethyl-diethoxy-methylsilane (CID 16650) is chloromethyl-diethoxy-methylsilane.
What is the SMILES notation for chloromethyl-diethoxy-methylsilane?
The canonical SMILES for chloromethyl-diethoxy-methylsilane is CCO[Si](C)(CCl)OCC.
What is the InChIKey of chloromethyl-diethoxy-methylsilane?
The InChIKey is XGLLBUISUZEUMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15ClO2Si/c1-4-8-10(3,6-7)9-5-2/h4-6H2,1-3H3.
What are the key properties of chloromethyl-diethoxy-methylsilane?
chloromethyl-diethoxy-methylsilane has a molecular weight of 182.72 g/mol, XLogP of 1.91, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl-diethoxy-methylsilane is sourced from PubChem (CID 16650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).