triethyl(oct-1-ynyl)silane

C14H28Si — CID 11790858

IUPACtriethyl(oct-1-ynyl)silane
SMILESCCCCCCC#C[Si](CC)(CC)CC
InChIInChI=1S/C14H28Si/c1-5-9-10-11-12-13-14-15(6-2,7-3)8-4/h5-12H2,1-4H3
InChIKeyQIRFAHZLYHSDJF-UHFFFAOYSA-N
MW224.46 g/mol
LogP5.01
Rot. Bonds7

About triethyl(oct-1-ynyl)silane

triethyl(oct-1-ynyl)silane (PubChem CID 11790858) has the molecular formula C14H28Si and a molecular weight of 224.46 g/mol. Its IUPAC name is triethyl(oct-1-ynyl)silane.

Molecular Properties

Compound Nametriethyl(oct-1-ynyl)silane
PubChem CID11790858
Molecular FormulaC14H28Si
Molecular Weight224.46 g/mol
Exact Mass224.20
IUPAC Nametriethyl(oct-1-ynyl)silane
SMILESCCCCCCC#C[Si](CC)(CC)CC
InChIInChI=1S/C14H28Si/c1-5-9-10-11-12-13-14-15(6-2,7-3)8-4/h5-12H2,1-4H3
InChIKeyQIRFAHZLYHSDJF-UHFFFAOYSA-N
XLogP5.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500224.46
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze triethyl(oct-1-ynyl)silane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of triethyl(oct-1-ynyl)silane?
The IUPAC name of triethyl(oct-1-ynyl)silane (CID 11790858) is triethyl(oct-1-ynyl)silane.
What is the SMILES notation for triethyl(oct-1-ynyl)silane?
The canonical SMILES for triethyl(oct-1-ynyl)silane is CCCCCCC#C[Si](CC)(CC)CC.
What is the InChIKey of triethyl(oct-1-ynyl)silane?
The InChIKey is QIRFAHZLYHSDJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28Si/c1-5-9-10-11-12-13-14-15(6-2,7-3)8-4/h5-12H2,1-4H3.
What are the key properties of triethyl(oct-1-ynyl)silane?
triethyl(oct-1-ynyl)silane has a molecular weight of 224.46 g/mol, XLogP of 5.01, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(oct-1-ynyl)silane is sourced from PubChem (CID 11790858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).