ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane

C13H29BO2Si — CID 21609171

IUPACethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane
SMILESB(CC)(/C(=C(/C)\[Si](C)(C)OCC)/CC)OCC
InChIInChI=1S/C13H29BO2Si/c1-8-13(14(9-2)15-10-3)12(5)17(6,7)16-11-4/h8-11H2,1-7H3/b13-12-
InChIKeyHUYZQQPZYSVDQE-SEYXRHQNSA-N
MW256.27 g/mol
LogP—
Rot. Bonds8

About ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane

ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane (PubChem CID 21609171) has the molecular formula C13H29BO2Si and a molecular weight of 256.27 g/mol. Its IUPAC name is ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane.

Molecular Properties

Compound Nameethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane
PubChem CID21609171
Molecular FormulaC13H29BO2Si
Molecular Weight256.27 g/mol
Exact Mass256.20
IUPAC Nameethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane
SMILESB(CC)(/C(=C(/C)\[Si](C)(C)OCC)/CC)OCC
InChIInChI=1S/C13H29BO2Si/c1-8-13(14(9-2)15-10-3)12(5)17(6,7)16-11-4/h8-11H2,1-7H3/b13-12-
InChIKeyHUYZQQPZYSVDQE-SEYXRHQNSA-N
XLogP—
TPSA18.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity252

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane?
The IUPAC name of ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane (CID 21609171) is ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane.
What is the SMILES notation for ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane?
The canonical SMILES for ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane is B(CC)(/C(=C(/C)\[Si](C)(C)OCC)/CC)OCC.
What is the InChIKey of ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane?
The InChIKey is HUYZQQPZYSVDQE-SEYXRHQNSA-N. The full InChI is InChI=1S/C13H29BO2Si/c1-8-13(14(9-2)15-10-3)12(5)17(6,7)16-11-4/h8-11H2,1-7H3/b13-12-.
What are the key properties of ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane?
ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane has a molecular weight of 256.27 g/mol, XLogP of not available, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane is sourced from PubChem (CID 21609171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).