but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane

C12H28O3Si2 — CID 91733548

IUPACbut-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane
SMILESC=CCCO[Si](C)(C)O[Si](C)(C)OCC(C)C
InChIInChI=1S/C12H28O3Si2/c1-8-9-10-13-16(4,5)15-17(6,7)14-11-12(2)3/h8,12H,1,9-11H2,2-7H3
InChIKeyFIBPKFODXOWDJJ-UHFFFAOYSA-N
MW276.52 g/mol
LogP3.67
Rot. Bonds9

About but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane

but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane (PubChem CID 91733548) has the molecular formula C12H28O3Si2 and a molecular weight of 276.52 g/mol. Its IUPAC name is but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane.

Molecular Properties

Compound Namebut-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane
PubChem CID91733548
Molecular FormulaC12H28O3Si2
Molecular Weight276.52 g/mol
Exact Mass276.16
IUPAC Namebut-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane
SMILESC=CCCO[Si](C)(C)O[Si](C)(C)OCC(C)C
InChIInChI=1S/C12H28O3Si2/c1-8-9-10-13-16(4,5)15-17(6,7)14-11-12(2)3/h8,12H,1,9-11H2,2-7H3
InChIKeyFIBPKFODXOWDJJ-UHFFFAOYSA-N
XLogP3.67
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.52
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane?
The IUPAC name of but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane (CID 91733548) is but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane.
What is the SMILES notation for but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane?
The canonical SMILES for but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane is C=CCCO[Si](C)(C)O[Si](C)(C)OCC(C)C.
What is the InChIKey of but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane?
The InChIKey is FIBPKFODXOWDJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O3Si2/c1-8-9-10-13-16(4,5)15-17(6,7)14-11-12(2)3/h8,12H,1,9-11H2,2-7H3.
What are the key properties of but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane?
but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane has a molecular weight of 276.52 g/mol, XLogP of 3.67, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-enoxy-[dimethyl(2-methylpropoxy)silyl]oxy-dimethylsilane is sourced from PubChem (CID 91733548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).