triethoxy-[(E)-3-ethoxyprop-1-enyl]silane

C11H24O4Si — CID 12980545

IUPACtriethoxy-[(E)-3-ethoxyprop-1-enyl]silane
SMILESCCOC/C=C/[Si](OCC)(OCC)OCC
InChIInChI=1S/C11H24O4Si/c1-5-12-10-9-11-16(13-6-2,14-7-3)15-8-4/h9,11H,5-8,10H2,1-4H3/b11-9+
InChIKeyAKQJGFYKAFAXBB-PKNBQFBNSA-N
MW248.39 g/mol
LogP2.17
Rot. Bonds10

About triethoxy-[(E)-3-ethoxyprop-1-enyl]silane

triethoxy-[(E)-3-ethoxyprop-1-enyl]silane (PubChem CID 12980545) has the molecular formula C11H24O4Si and a molecular weight of 248.39 g/mol. Its IUPAC name is triethoxy-[(E)-3-ethoxyprop-1-enyl]silane.

Molecular Properties

Compound Nametriethoxy-[(E)-3-ethoxyprop-1-enyl]silane
PubChem CID12980545
Molecular FormulaC11H24O4Si
Molecular Weight248.39 g/mol
Exact Mass248.14
IUPAC Nametriethoxy-[(E)-3-ethoxyprop-1-enyl]silane
SMILESCCOC/C=C/[Si](OCC)(OCC)OCC
InChIInChI=1S/C11H24O4Si/c1-5-12-10-9-11-16(13-6-2,14-7-3)15-8-4/h9,11H,5-8,10H2,1-4H3/b11-9+
InChIKeyAKQJGFYKAFAXBB-PKNBQFBNSA-N
XLogP2.17
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethoxy-[(E)-3-ethoxyprop-1-enyl]silane?
The IUPAC name of triethoxy-[(E)-3-ethoxyprop-1-enyl]silane (CID 12980545) is triethoxy-[(E)-3-ethoxyprop-1-enyl]silane.
What is the SMILES notation for triethoxy-[(E)-3-ethoxyprop-1-enyl]silane?
The canonical SMILES for triethoxy-[(E)-3-ethoxyprop-1-enyl]silane is CCOC/C=C/[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy-[(E)-3-ethoxyprop-1-enyl]silane?
The InChIKey is AKQJGFYKAFAXBB-PKNBQFBNSA-N. The full InChI is InChI=1S/C11H24O4Si/c1-5-12-10-9-11-16(13-6-2,14-7-3)15-8-4/h9,11H,5-8,10H2,1-4H3/b11-9+.
What are the key properties of triethoxy-[(E)-3-ethoxyprop-1-enyl]silane?
triethoxy-[(E)-3-ethoxyprop-1-enyl]silane has a molecular weight of 248.39 g/mol, XLogP of 2.17, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[(E)-3-ethoxyprop-1-enyl]silane is sourced from PubChem (CID 12980545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).