tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane

C13H28O3Si — CID 58406057

IUPACtert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane
SMILESC=CC(COCCO[Si](C)(C)C(C)(C)C)OC
InChIInChI=1S/C13H28O3Si/c1-8-12(14-5)11-15-9-10-16-17(6,7)13(2,3)4/h8,12H,1,9-11H2,2-7H3
InChIKeyHYUWIAKHHABGBX-UHFFFAOYSA-N
MW260.45 g/mol
LogP3.23
Rot. Bonds8

About tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane

tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane (PubChem CID 58406057) has the molecular formula C13H28O3Si and a molecular weight of 260.45 g/mol. Its IUPAC name is tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane
PubChem CID58406057
Molecular FormulaC13H28O3Si
Molecular Weight260.45 g/mol
Exact Mass260.18
IUPAC Nametert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane
SMILESC=CC(COCCO[Si](C)(C)C(C)(C)C)OC
InChIInChI=1S/C13H28O3Si/c1-8-12(14-5)11-15-9-10-16-17(6,7)13(2,3)4/h8,12H,1,9-11H2,2-7H3
InChIKeyHYUWIAKHHABGBX-UHFFFAOYSA-N
XLogP3.23
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.45
LogP ≤ 53.23
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 tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane (CID 58406057) is tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane is C=CC(COCCO[Si](C)(C)C(C)(C)C)OC.
What is the InChIKey of tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane?
The InChIKey is HYUWIAKHHABGBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O3Si/c1-8-12(14-5)11-15-9-10-16-17(6,7)13(2,3)4/h8,12H,1,9-11H2,2-7H3.
What are the key properties of tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane?
tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane has a molecular weight of 260.45 g/mol, XLogP of 3.23, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane is sourced from PubChem (CID 58406057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).