triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane

C13H28O5Si — CID 11346874

IUPACtriethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane
SMILESCCO[Si](CCCOCC1COC1)(OCC)OCC
InChIInChI=1S/C13H28O5Si/c1-4-16-19(17-5-2,18-6-3)9-7-8-14-10-13-11-15-12-13/h13H,4-12H2,1-3H3
InChIKeyGCBJCBVKCCEPAN-UHFFFAOYSA-N
MW292.45 g/mol
LogP2.09
Rot. Bonds12

About triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane

triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane (PubChem CID 11346874) has the molecular formula C13H28O5Si and a molecular weight of 292.45 g/mol. Its IUPAC name is triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane.

Molecular Properties

Compound Nametriethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane
PubChem CID11346874
Molecular FormulaC13H28O5Si
Molecular Weight292.45 g/mol
Exact Mass292.17
IUPAC Nametriethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane
SMILESCCO[Si](CCCOCC1COC1)(OCC)OCC
InChIInChI=1S/C13H28O5Si/c1-4-16-19(17-5-2,18-6-3)9-7-8-14-10-13-11-15-12-13/h13H,4-12H2,1-3H3
InChIKeyGCBJCBVKCCEPAN-UHFFFAOYSA-N
XLogP2.09
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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-[3-(oxetan-3-ylmethoxy)propyl]silane?
The IUPAC name of triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane (CID 11346874) is triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane.
What is the SMILES notation for triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane?
The canonical SMILES for triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane is CCO[Si](CCCOCC1COC1)(OCC)OCC.
What is the InChIKey of triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane?
The InChIKey is GCBJCBVKCCEPAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O5Si/c1-4-16-19(17-5-2,18-6-3)9-7-8-14-10-13-11-15-12-13/h13H,4-12H2,1-3H3.
What are the key properties of triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane?
triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane has a molecular weight of 292.45 g/mol, XLogP of 2.09, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[3-(oxetan-3-ylmethoxy)propyl]silane is sourced from PubChem (CID 11346874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).