tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane

C14H28O2SeSi — CID 12929561

IUPACtert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane
SMILESCCOC(C)OC(=C=C[Se]C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H28O2SeSi/c1-9-15-12(2)16-13(10-11-17-6)18(7,8)14(3,4)5/h11-12H,9H2,1-8H3
InChIKeyOACYYZBSYFBFCO-UHFFFAOYSA-N
MW335.42 g/mol
LogP4.18
Rot. Bonds6

About tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane

tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane (PubChem CID 12929561) has the molecular formula C14H28O2SeSi and a molecular weight of 335.42 g/mol. Its IUPAC name is tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane
PubChem CID12929561
Molecular FormulaC14H28O2SeSi
Molecular Weight335.42 g/mol
Exact Mass336.10
IUPAC Nametert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane
SMILESCCOC(C)OC(=C=C[Se]C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H28O2SeSi/c1-9-15-12(2)16-13(10-11-17-6)18(7,8)14(3,4)5/h11-12H,9H2,1-8H3
InChIKeyOACYYZBSYFBFCO-UHFFFAOYSA-N
XLogP4.18
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.42
LogP ≤ 54.18
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 tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane?
The IUPAC name of tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane (CID 12929561) is tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane?
The canonical SMILES for tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane is CCOC(C)OC(=C=C[Se]C)[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane?
The InChIKey is OACYYZBSYFBFCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2SeSi/c1-9-15-12(2)16-13(10-11-17-6)18(7,8)14(3,4)5/h11-12H,9H2,1-8H3.
What are the key properties of tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane?
tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane has a molecular weight of 335.42 g/mol, XLogP of 4.18, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[1-(1-ethoxyethoxy)-3-methylselanylpropa-1,2-dienyl]-dimethylsilane is sourced from PubChem (CID 12929561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).