triethoxy(hex-5-enyl)silane

C12H26O3Si — CID 22145149

IUPACtriethoxy(hex-5-enyl)silane
SMILESC=CCCCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H26O3Si/c1-5-9-10-11-12-16(13-6-2,14-7-3)15-8-4/h5H,1,6-12H2,2-4H3
InChIKeyRKYSDIOEHLMYRS-UHFFFAOYSA-N
MW246.42 g/mol
LogP3.39
Rot. Bonds11

About triethoxy(hex-5-enyl)silane

triethoxy(hex-5-enyl)silane (PubChem CID 22145149) has the molecular formula C12H26O3Si and a molecular weight of 246.42 g/mol. Its IUPAC name is triethoxy(hex-5-enyl)silane.

Molecular Properties

Compound Nametriethoxy(hex-5-enyl)silane
PubChem CID22145149
Molecular FormulaC12H26O3Si
Molecular Weight246.42 g/mol
Exact Mass246.17
IUPAC Nametriethoxy(hex-5-enyl)silane
SMILESC=CCCCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H26O3Si/c1-5-9-10-11-12-16(13-6-2,14-7-3)15-8-4/h5H,1,6-12H2,2-4H3
InChIKeyRKYSDIOEHLMYRS-UHFFFAOYSA-N
XLogP3.39
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.42
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triethoxy(hex-5-enyl)silane?
The IUPAC name of triethoxy(hex-5-enyl)silane (CID 22145149) is triethoxy(hex-5-enyl)silane.
What is the SMILES notation for triethoxy(hex-5-enyl)silane?
The canonical SMILES for triethoxy(hex-5-enyl)silane is C=CCCCC[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy(hex-5-enyl)silane?
The InChIKey is RKYSDIOEHLMYRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O3Si/c1-5-9-10-11-12-16(13-6-2,14-7-3)15-8-4/h5H,1,6-12H2,2-4H3.
What are the key properties of triethoxy(hex-5-enyl)silane?
triethoxy(hex-5-enyl)silane has a molecular weight of 246.42 g/mol, XLogP of 3.39, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(hex-5-enyl)silane is sourced from PubChem (CID 22145149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).