3,4-dimethylpenta-1,3-dienoxy(triethyl)silane

C13H26OSi — CID 54355677

IUPAC3,4-dimethylpenta-1,3-dienoxy(triethyl)silane
SMILESCC[Si](CC)(CC)OC=CC(C)=C(C)C
InChIInChI=1S/C13H26OSi/c1-7-15(8-2,9-3)14-11-10-13(6)12(4)5/h10-11H,7-9H2,1-6H3
InChIKeyUIXWPHGLFLPMQE-UHFFFAOYSA-N
MW226.44 g/mol
LogP4.88
Rot. Bonds6

About 3,4-dimethylpenta-1,3-dienoxy(triethyl)silane

3,4-dimethylpenta-1,3-dienoxy(triethyl)silane (PubChem CID 54355677) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is 3,4-dimethylpenta-1,3-dienoxy(triethyl)silane.

Molecular Properties

Compound Name3,4-dimethylpenta-1,3-dienoxy(triethyl)silane
PubChem CID54355677
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Name3,4-dimethylpenta-1,3-dienoxy(triethyl)silane
SMILESCC[Si](CC)(CC)OC=CC(C)=C(C)C
InChIInChI=1S/C13H26OSi/c1-7-15(8-2,9-3)14-11-10-13(6)12(4)5/h10-11H,7-9H2,1-6H3
InChIKeyUIXWPHGLFLPMQE-UHFFFAOYSA-N
XLogP4.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethylpenta-1,3-dienoxy(triethyl)silane?
The IUPAC name of 3,4-dimethylpenta-1,3-dienoxy(triethyl)silane (CID 54355677) is 3,4-dimethylpenta-1,3-dienoxy(triethyl)silane.
What is the SMILES notation for 3,4-dimethylpenta-1,3-dienoxy(triethyl)silane?
The canonical SMILES for 3,4-dimethylpenta-1,3-dienoxy(triethyl)silane is CC[Si](CC)(CC)OC=CC(C)=C(C)C.
What is the InChIKey of 3,4-dimethylpenta-1,3-dienoxy(triethyl)silane?
The InChIKey is UIXWPHGLFLPMQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-7-15(8-2,9-3)14-11-10-13(6)12(4)5/h10-11H,7-9H2,1-6H3.
What are the key properties of 3,4-dimethylpenta-1,3-dienoxy(triethyl)silane?
3,4-dimethylpenta-1,3-dienoxy(triethyl)silane has a molecular weight of 226.44 g/mol, XLogP of 4.88, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethylpenta-1,3-dienoxy(triethyl)silane is sourced from PubChem (CID 54355677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).