1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane

C11H22O2Si — CID 12929553

IUPAC1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane
SMILESCC=C=C(OC(C)OCC)[Si](C)(C)C
InChIInChI=1S/C11H22O2Si/c1-7-9-11(14(4,5)6)13-10(3)12-8-2/h7,10H,8H2,1-6H3
InChIKeyZDHIMWZYGJAOFC-UHFFFAOYSA-N
MW214.38 g/mol
LogP3.32
Rot. Bonds5

About 1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane

1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane (PubChem CID 12929553) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is 1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane.

Molecular Properties

Compound Name1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane
PubChem CID12929553
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Name1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane
SMILESCC=C=C(OC(C)OCC)[Si](C)(C)C
InChIInChI=1S/C11H22O2Si/c1-7-9-11(14(4,5)6)13-10(3)12-8-2/h7,10H,8H2,1-6H3
InChIKeyZDHIMWZYGJAOFC-UHFFFAOYSA-N
XLogP3.32
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane?
The IUPAC name of 1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane (CID 12929553) is 1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane.
What is the SMILES notation for 1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane?
The canonical SMILES for 1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane is CC=C=C(OC(C)OCC)[Si](C)(C)C.
What is the InChIKey of 1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane?
The InChIKey is ZDHIMWZYGJAOFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-7-9-11(14(4,5)6)13-10(3)12-8-2/h7,10H,8H2,1-6H3.
What are the key properties of 1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane?
1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane has a molecular weight of 214.38 g/mol, XLogP of 3.32, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethoxyethoxy)buta-1,2-dienyl-trimethylsilane is sourced from PubChem (CID 12929553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).