triethoxy(oct-5-ynyl)silane

C14H28O3Si — CID 87600439

IUPACtriethoxy(oct-5-ynyl)silane
SMILESCCC#CCCCC[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/h5-8,11-14H2,1-4H3
InChIKeyJDCWCPPYUPXLSR-UHFFFAOYSA-N
MW272.46 g/mol
LogP3.62
Rot. Bonds10

About triethoxy(oct-5-ynyl)silane

triethoxy(oct-5-ynyl)silane (PubChem CID 87600439) has the molecular formula C14H28O3Si and a molecular weight of 272.46 g/mol. Its IUPAC name is triethoxy(oct-5-ynyl)silane.

Molecular Properties

Compound Nametriethoxy(oct-5-ynyl)silane
PubChem CID87600439
Molecular FormulaC14H28O3Si
Molecular Weight272.46 g/mol
Exact Mass272.18
IUPAC Nametriethoxy(oct-5-ynyl)silane
SMILESCCC#CCCCC[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/h5-8,11-14H2,1-4H3
InChIKeyJDCWCPPYUPXLSR-UHFFFAOYSA-N
XLogP3.62
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 53.62
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': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

Pentyltriethoxysilane
CID 17695
Silane, triethoxyhexyl-
CID 4437318
Triethoxy(hexan-2-yl)silane
CID 85700743
Trimethyl({[4-(trimethylsilyl)but-3-yn-1-yl]oxy})silane
CID 11745995
Diisopropyl-(3-pentynyloxy)silane
CID 59925975
Silane, (3-butynyloxy)tris(1-methylethyl)-
CID 10857164
Tert-butyl-dimethyl-pent-3-ynoxysilane
CID 11769487
(Hept-3-ynyloxy)trimethylsilane
CID 13981616
Triethoxysilyl-propyl acetylene
CID 88314764
Hex-1-ynyl(trimethoxy)silane
CID 139613203
Silane, dimethyl(non-5-yn-3-yloxy)ethoxy-
CID 91723674
Silane, dimethyl(non-5-yn-3-yloxy)propoxy-
CID 91726699

Frequently Asked Questions

What is the IUPAC name of triethoxy(oct-5-ynyl)silane?
The IUPAC name of triethoxy(oct-5-ynyl)silane (CID 87600439) is triethoxy(oct-5-ynyl)silane.
What is the SMILES notation for triethoxy(oct-5-ynyl)silane?
The canonical SMILES for triethoxy(oct-5-ynyl)silane is CCC#CCCCC[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy(oct-5-ynyl)silane?
The InChIKey is JDCWCPPYUPXLSR-UHFFFAOYSA-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/h5-8,11-14H2,1-4H3.
What are the key properties of triethoxy(oct-5-ynyl)silane?
triethoxy(oct-5-ynyl)silane has a molecular weight of 272.46 g/mol, XLogP of 3.62, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(oct-5-ynyl)silane is sourced from PubChem (CID 87600439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).