2-(4-ethenoxybutoxy)ethyl-triethoxysilane

C14H30O5Si — CID 10924800

IUPAC2-(4-ethenoxybutoxy)ethyl-triethoxysilane
SMILESC=COCCCCOCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H30O5Si/c1-5-15-11-9-10-12-16-13-14-20(17-6-2,18-7-3)19-8-4/h5H,1,6-14H2,2-4H3
InChIKeyPXVPUNYYUMRBDU-UHFFFAOYSA-N
MW306.47 g/mol
LogP2.99
Rot. Bonds15

About 2-(4-ethenoxybutoxy)ethyl-triethoxysilane

2-(4-ethenoxybutoxy)ethyl-triethoxysilane (PubChem CID 10924800) has the molecular formula C14H30O5Si and a molecular weight of 306.47 g/mol. Its IUPAC name is 2-(4-ethenoxybutoxy)ethyl-triethoxysilane.

Molecular Properties

Compound Name2-(4-ethenoxybutoxy)ethyl-triethoxysilane
PubChem CID10924800
Molecular FormulaC14H30O5Si
Molecular Weight306.47 g/mol
Exact Mass306.19
IUPAC Name2-(4-ethenoxybutoxy)ethyl-triethoxysilane
SMILESC=COCCCCOCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H30O5Si/c1-5-15-11-9-10-12-16-13-14-20(17-6-2,18-7-3)19-8-4/h5H,1,6-14H2,2-4H3
InChIKeyPXVPUNYYUMRBDU-UHFFFAOYSA-N
XLogP2.99
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.47
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'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 2-(4-ethenoxybutoxy)ethyl-triethoxysilane?
The IUPAC name of 2-(4-ethenoxybutoxy)ethyl-triethoxysilane (CID 10924800) is 2-(4-ethenoxybutoxy)ethyl-triethoxysilane.
What is the SMILES notation for 2-(4-ethenoxybutoxy)ethyl-triethoxysilane?
The canonical SMILES for 2-(4-ethenoxybutoxy)ethyl-triethoxysilane is C=COCCCCOCC[Si](OCC)(OCC)OCC.
What is the InChIKey of 2-(4-ethenoxybutoxy)ethyl-triethoxysilane?
The InChIKey is PXVPUNYYUMRBDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O5Si/c1-5-15-11-9-10-12-16-13-14-20(17-6-2,18-7-3)19-8-4/h5H,1,6-14H2,2-4H3.
What are the key properties of 2-(4-ethenoxybutoxy)ethyl-triethoxysilane?
2-(4-ethenoxybutoxy)ethyl-triethoxysilane has a molecular weight of 306.47 g/mol, XLogP of 2.99, 15 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethenoxybutoxy)ethyl-triethoxysilane is sourced from PubChem (CID 10924800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).