ethenyl(triethyl)silane carbonate

C9H18O3Si-2 — CID 19812768

IUPACethenyl(triethyl)silane carbonate
SMILESC=C[Si](CC)(CC)CC.O=C([O-])[O-]
InChIInChI=1S/C8H18Si.CH2O3/c1-5-9(6-2,7-3)8-4;2-1(3)4/h5H,1,6-8H2,2-4H3;(H2,2,3,4)/p-2
InChIKeyZKRYQHHCLZCCAU-UHFFFAOYSA-L
MW202.33 g/mol
LogP0.77
Rot. Bonds4

About ethenyl(triethyl)silane carbonate

ethenyl(triethyl)silane carbonate (PubChem CID 19812768) has the molecular formula C9H18O3Si-2 and a molecular weight of 202.33 g/mol. Its IUPAC name is ethenyl(triethyl)silane carbonate.

Molecular Properties

Compound Nameethenyl(triethyl)silane carbonate
PubChem CID19812768
Molecular FormulaC9H18O3Si-2
Molecular Weight202.33 g/mol
Exact Mass202.10
IUPAC Nameethenyl(triethyl)silane carbonate
SMILESC=C[Si](CC)(CC)CC.O=C([O-])[O-]
InChIInChI=1S/C8H18Si.CH2O3/c1-5-9(6-2,7-3)8-4;2-1(3)4/h5H,1,6-8H2,2-4H3;(H2,2,3,4)/p-2
InChIKeyZKRYQHHCLZCCAU-UHFFFAOYSA-L
XLogP0.77
TPSA63.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.33
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 ethenyl(triethyl)silane carbonate?
The IUPAC name of ethenyl(triethyl)silane carbonate (CID 19812768) is ethenyl(triethyl)silane carbonate.
What is the SMILES notation for ethenyl(triethyl)silane carbonate?
The canonical SMILES for ethenyl(triethyl)silane carbonate is C=C[Si](CC)(CC)CC.O=C([O-])[O-].
What is the InChIKey of ethenyl(triethyl)silane carbonate?
The InChIKey is ZKRYQHHCLZCCAU-UHFFFAOYSA-L. The full InChI is InChI=1S/C8H18Si.CH2O3/c1-5-9(6-2,7-3)8-4;2-1(3)4/h5H,1,6-8H2,2-4H3;(H2,2,3,4)/p-2.
What are the key properties of ethenyl(triethyl)silane carbonate?
ethenyl(triethyl)silane carbonate has a molecular weight of 202.33 g/mol, XLogP of 0.77, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl(triethyl)silane carbonate is sourced from PubChem (CID 19812768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).