triethoxysilylmethyl acetate

C9H20O5Si — CID 11528804

IUPACtriethoxysilylmethyl acetate
SMILESCCO[Si](COC(C)=O)(OCC)OCC
InChIInChI=1S/C9H20O5Si/c1-5-12-15(13-6-2,14-7-3)8-11-9(4)10/h5-8H2,1-4H3
InChIKeyCSDVDSUBFYNSMC-UHFFFAOYSA-N
MW236.34 g/mol
LogP1.14
Rot. Bonds8

About triethoxysilylmethyl acetate

triethoxysilylmethyl acetate (PubChem CID 11528804) has the molecular formula C9H20O5Si and a molecular weight of 236.34 g/mol. Its IUPAC name is triethoxysilylmethyl acetate.

Molecular Properties

Compound Nametriethoxysilylmethyl acetate
PubChem CID11528804
Molecular FormulaC9H20O5Si
Molecular Weight236.34 g/mol
Exact Mass236.11
IUPAC Nametriethoxysilylmethyl acetate
SMILESCCO[Si](COC(C)=O)(OCC)OCC
InChIInChI=1S/C9H20O5Si/c1-5-12-15(13-6-2,14-7-3)8-11-9(4)10/h5-8H2,1-4H3
InChIKeyCSDVDSUBFYNSMC-UHFFFAOYSA-N
XLogP1.14
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 triethoxysilylmethyl acetate?
The IUPAC name of triethoxysilylmethyl acetate (CID 11528804) is triethoxysilylmethyl acetate.
What is the SMILES notation for triethoxysilylmethyl acetate?
The canonical SMILES for triethoxysilylmethyl acetate is CCO[Si](COC(C)=O)(OCC)OCC.
What is the InChIKey of triethoxysilylmethyl acetate?
The InChIKey is CSDVDSUBFYNSMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O5Si/c1-5-12-15(13-6-2,14-7-3)8-11-9(4)10/h5-8H2,1-4H3.
What are the key properties of triethoxysilylmethyl acetate?
triethoxysilylmethyl acetate has a molecular weight of 236.34 g/mol, XLogP of 1.14, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxysilylmethyl acetate is sourced from PubChem (CID 11528804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).