triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane

C14H28O5Si — CID 154062900

IUPACtriethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane
SMILESCC=CC(C[Si](OCC)(OCC)OCC)OCC1CO1
InChIInChI=1S/C14H28O5Si/c1-5-9-13(15-10-14-11-16-14)12-20(17-6-2,18-7-3)19-8-4/h5,9,13-14H,6-8,10-12H2,1-4H3
InChIKeyPKVJJBRZOOYMBY-UHFFFAOYSA-N
MW304.46 g/mol
LogP2.39
Rot. Bonds12

About triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane

triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane (PubChem CID 154062900) has the molecular formula C14H28O5Si and a molecular weight of 304.46 g/mol. Its IUPAC name is triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane.

Molecular Properties

Compound Nametriethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane
PubChem CID154062900
Molecular FormulaC14H28O5Si
Molecular Weight304.46 g/mol
Exact Mass304.17
IUPAC Nametriethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane
SMILESCC=CC(C[Si](OCC)(OCC)OCC)OCC1CO1
InChIInChI=1S/C14H28O5Si/c1-5-9-13(15-10-14-11-16-14)12-20(17-6-2,18-7-3)19-8-4/h5,9,13-14H,6-8,10-12H2,1-4H3
InChIKeyPKVJJBRZOOYMBY-UHFFFAOYSA-N
XLogP2.39
TPSA49.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.46
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

ethoxysilane;triethoxy-[2-(oxiran-2-ylmethoxy)propyl]silane
CID 160854237
1-(oxiran-2-ylmethoxy)-3-triethoxysilylpropan-2-amine
CID 141352080
triethyl 1-(oxiran-2-ylmethoxy)propyl silicate
CID 87343649
2-(oxiran-2-ylmethoxy)propyl-tripropoxysilane
CID 22169298
diethoxy-methyl-[(1S)-1-(oxiran-2-ylmethoxy)-1-silylpropan-2-yl]silane
CID 175014951
diethoxy(dimethyl)silane;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 158655964
triethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane;trimethoxy-[1-(oxiran-2-ylmethoxy)propyl]silane
CID 87862101
diethoxy-[oxiran-2-ylmethoxy(triethoxysilyl)methyl]-propylsilane
CID 150689843
triethoxy(oxiran-2-ylmethoxymethyl)silane;trimethoxy(oxiran-2-ylmethoxymethyl)silane
CID 87862133
diethoxy-methyl-[1-(oxiran-2-ylmethoxy)propyl]silane;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 87666631
2-(hex-4-en-2-yloxymethyl)oxirane
CID 89335517
2-(propan-2-yloxymethyl)oxirane
CID 159998967

Frequently Asked Questions

What is the IUPAC name of triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane?
The IUPAC name of triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane (CID 154062900) is triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane.
What is the SMILES notation for triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane?
The canonical SMILES for triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane is CC=CC(C[Si](OCC)(OCC)OCC)OCC1CO1.
What is the InChIKey of triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane?
The InChIKey is PKVJJBRZOOYMBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O5Si/c1-5-9-13(15-10-14-11-16-14)12-20(17-6-2,18-7-3)19-8-4/h5,9,13-14H,6-8,10-12H2,1-4H3.
What are the key properties of triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane?
triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane has a molecular weight of 304.46 g/mol, XLogP of 2.39, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[2-(oxiran-2-ylmethoxy)pent-3-enyl]silane is sourced from PubChem (CID 154062900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).