bis(4-chlorobutoxy)-dimethylsilane

C10H22Cl2O2Si — CID 15185643

IUPACbis(4-chlorobutoxy)-dimethylsilane
SMILESC[Si](C)(OCCCCCl)OCCCCCl
InChIInChI=1S/C10H22Cl2O2Si/c1-15(2,13-9-5-3-7-11)14-10-6-4-8-12/h3-10H2,1-2H3
InChIKeyONKQRRQVQIZCHJ-UHFFFAOYSA-N
MW273.28 g/mol
LogP3.76
Rot. Bonds10

About bis(4-chlorobutoxy)-dimethylsilane

bis(4-chlorobutoxy)-dimethylsilane (PubChem CID 15185643) has the molecular formula C10H22Cl2O2Si and a molecular weight of 273.28 g/mol. Its IUPAC name is bis(4-chlorobutoxy)-dimethylsilane.

Molecular Properties

Compound Namebis(4-chlorobutoxy)-dimethylsilane
PubChem CID15185643
Molecular FormulaC10H22Cl2O2Si
Molecular Weight273.28 g/mol
Exact Mass272.08
IUPAC Namebis(4-chlorobutoxy)-dimethylsilane
SMILESC[Si](C)(OCCCCCl)OCCCCCl
InChIInChI=1S/C10H22Cl2O2Si/c1-15(2,13-9-5-3-7-11)14-10-6-4-8-12/h3-10H2,1-2H3
InChIKeyONKQRRQVQIZCHJ-UHFFFAOYSA-N
XLogP3.76
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.28
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 bis(4-chlorobutoxy)-dimethylsilane?
The IUPAC name of bis(4-chlorobutoxy)-dimethylsilane (CID 15185643) is bis(4-chlorobutoxy)-dimethylsilane.
What is the SMILES notation for bis(4-chlorobutoxy)-dimethylsilane?
The canonical SMILES for bis(4-chlorobutoxy)-dimethylsilane is C[Si](C)(OCCCCCl)OCCCCCl.
What is the InChIKey of bis(4-chlorobutoxy)-dimethylsilane?
The InChIKey is ONKQRRQVQIZCHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22Cl2O2Si/c1-15(2,13-9-5-3-7-11)14-10-6-4-8-12/h3-10H2,1-2H3.
What are the key properties of bis(4-chlorobutoxy)-dimethylsilane?
bis(4-chlorobutoxy)-dimethylsilane has a molecular weight of 273.28 g/mol, XLogP of 3.76, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-chlorobutoxy)-dimethylsilane is sourced from PubChem (CID 15185643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).