ethoxy-dimethyl-octan-2-yloxysilane

C12H28O2Si — CID 91719383

IUPACethoxy-dimethyl-octan-2-yloxysilane
SMILESCCCCCCC(C)O[Si](C)(C)OCC
InChIInChI=1S/C12H28O2Si/c1-6-8-9-10-11-12(3)14-15(4,5)13-7-2/h12H,6-11H2,1-5H3
InChIKeyLQCHUJSEXYSSPH-UHFFFAOYSA-N
MW232.44 g/mol
LogP4.10
Rot. Bonds9

About ethoxy-dimethyl-octan-2-yloxysilane

ethoxy-dimethyl-octan-2-yloxysilane (PubChem CID 91719383) has the molecular formula C12H28O2Si and a molecular weight of 232.44 g/mol. Its IUPAC name is ethoxy-dimethyl-octan-2-yloxysilane.

Molecular Properties

Compound Nameethoxy-dimethyl-octan-2-yloxysilane
PubChem CID91719383
Molecular FormulaC12H28O2Si
Molecular Weight232.44 g/mol
Exact Mass232.19
IUPAC Nameethoxy-dimethyl-octan-2-yloxysilane
SMILESCCCCCCC(C)O[Si](C)(C)OCC
InChIInChI=1S/C12H28O2Si/c1-6-8-9-10-11-12(3)14-15(4,5)13-7-2/h12H,6-11H2,1-5H3
InChIKeyLQCHUJSEXYSSPH-UHFFFAOYSA-N
XLogP4.10
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.44
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethoxy-dimethyl-octan-2-yloxysilane?
The IUPAC name of ethoxy-dimethyl-octan-2-yloxysilane (CID 91719383) is ethoxy-dimethyl-octan-2-yloxysilane.
What is the SMILES notation for ethoxy-dimethyl-octan-2-yloxysilane?
The canonical SMILES for ethoxy-dimethyl-octan-2-yloxysilane is CCCCCCC(C)O[Si](C)(C)OCC.
What is the InChIKey of ethoxy-dimethyl-octan-2-yloxysilane?
The InChIKey is LQCHUJSEXYSSPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O2Si/c1-6-8-9-10-11-12(3)14-15(4,5)13-7-2/h12H,6-11H2,1-5H3.
What are the key properties of ethoxy-dimethyl-octan-2-yloxysilane?
ethoxy-dimethyl-octan-2-yloxysilane has a molecular weight of 232.44 g/mol, XLogP of 4.10, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-dimethyl-octan-2-yloxysilane is sourced from PubChem (CID 91719383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).