triethoxy-[(1E)-octa-1,7-dienyl]silane

C14H28O3Si — CID 22726340

IUPACtriethoxy-[(1E)-octa-1,7-dienyl]silane
SMILESC=CCCCC/C=C/[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H28O3Si/c1-5-9-10-11-12-13-14-18(15-6-2,16-7-3)17-8-4/h5,13-14H,1,6-12H2,2-4H3/b14-13+
InChIKeyIJZMXUOFUYKSCK-BUHFOSPRSA-N
MW272.46 g/mol
LogP3.88
Rot. Bonds12

About triethoxy-[(1E)-octa-1,7-dienyl]silane

triethoxy-[(1E)-octa-1,7-dienyl]silane (PubChem CID 22726340) has the molecular formula C14H28O3Si and a molecular weight of 272.46 g/mol. Its IUPAC name is triethoxy-[(1E)-octa-1,7-dienyl]silane.

Molecular Properties

Compound Nametriethoxy-[(1E)-octa-1,7-dienyl]silane
PubChem CID22726340
Molecular FormulaC14H28O3Si
Molecular Weight272.46 g/mol
Exact Mass272.18
IUPAC Nametriethoxy-[(1E)-octa-1,7-dienyl]silane
SMILESC=CCCCC/C=C/[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H28O3Si/c1-5-9-10-11-12-13-14-18(15-6-2,16-7-3)17-8-4/h5,13-14H,1,6-12H2,2-4H3/b14-13+
InChIKeyIJZMXUOFUYKSCK-BUHFOSPRSA-N
XLogP3.88
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 53.88
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'}

Analyze triethoxy-[(1E)-octa-1,7-dienyl]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

triethoxy-[(E)-hex-1-enyl]silane
CID 11184190
triethoxy(icos-1-enyl)silane
CID 140638362
triethoxy(undec-1-enyl)silane
CID 140758879
triethyl [(E)-6-triethoxysilylhex-5-enyl] silicate
CID 139977986
[(E)-6-triethoxysilylhex-5-enyl] acetate
CID 11324172
ethoxy-hex-5-enyl-dimethylsilane
CID 87088698
hexadeca-1,7,11-triene
CID 174048514
tripropoxy(tetradec-1-enyl)silane
CID 155797355
(Z)-dec-5-ene;hex-1-ene
CID 141304086
hexadec-6-ene;hex-1-ene
CID 158850904
pentadeca-1,7,10-triene
CID 174048702
hex-1-enyl(trimethoxy)silane
CID 54491862

Frequently Asked Questions

What is the IUPAC name of triethoxy-[(1E)-octa-1,7-dienyl]silane?
The IUPAC name of triethoxy-[(1E)-octa-1,7-dienyl]silane (CID 22726340) is triethoxy-[(1E)-octa-1,7-dienyl]silane.
What is the SMILES notation for triethoxy-[(1E)-octa-1,7-dienyl]silane?
The canonical SMILES for triethoxy-[(1E)-octa-1,7-dienyl]silane is C=CCCCC/C=C/[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy-[(1E)-octa-1,7-dienyl]silane?
The InChIKey is IJZMXUOFUYKSCK-BUHFOSPRSA-N. The full InChI is InChI=1S/C14H28O3Si/c1-5-9-10-11-12-13-14-18(15-6-2,16-7-3)17-8-4/h5,13-14H,1,6-12H2,2-4H3/b14-13+.
What are the key properties of triethoxy-[(1E)-octa-1,7-dienyl]silane?
triethoxy-[(1E)-octa-1,7-dienyl]silane has a molecular weight of 272.46 g/mol, XLogP of 3.88, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[(1E)-octa-1,7-dienyl]silane is sourced from PubChem (CID 22726340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).