triethoxy(henicosyl)silane

C27H58O3Si — CID 141362894

IUPACtriethoxy(henicosyl)silane
SMILESCCCCCCCCCCCCCCCCCCCCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C27H58O3Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-31(28-6-2,29-7-3)30-8-4/h5-27H2,1-4H3
InChIKeyJEAAMWVFSYAUEZ-UHFFFAOYSA-N
MW458.84 g/mol
LogP9.47
Rot. Bonds26

About triethoxy(henicosyl)silane

triethoxy(henicosyl)silane (PubChem CID 141362894) has the molecular formula C27H58O3Si and a molecular weight of 458.84 g/mol. Its IUPAC name is triethoxy(henicosyl)silane.

Molecular Properties

Compound Nametriethoxy(henicosyl)silane
PubChem CID141362894
Molecular FormulaC27H58O3Si
Molecular Weight458.84 g/mol
Exact Mass458.42
IUPAC Nametriethoxy(henicosyl)silane
SMILESCCCCCCCCCCCCCCCCCCCCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C27H58O3Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-31(28-6-2,29-7-3)30-8-4/h5-27H2,1-4H3
InChIKeyJEAAMWVFSYAUEZ-UHFFFAOYSA-N
XLogP9.47
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds26
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.84
LogP ≤ 59.47
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'}

Analyze triethoxy(henicosyl)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

dodecyl(triethoxy)silane;tridecane
CID 174970002
triethoxy(nonyl)silane;triethoxy(octyl)silane
CID 175508301
triethoxy(nonyl)silane;hydrofluoride
CID 161088856
silane;triethoxy(tetradecyl)silane
CID 161365398
triethoxy(pentyl)silane;hydrofluoride
CID 174582602
tetraethyl silicate;triethoxy(octyl)silane
CID 174926814
heptadecyl(trimethoxy)silane;triethoxy(heptadecyl)silane
CID 161331020
triethoxy(10-triethoxysilyldecyl)silane
CID 14439044
1-fluorotridecane;triethoxy(octyl)silane
CID 175426925
dodecyl-diethoxy-methoxysilane
CID 141483107
triethoxy(octadecyl)silane;trimethoxy(methyl)silane
CID 174457559
triethoxy(8-fluorohenicosyl)silane
CID 87070985

Frequently Asked Questions

What is the IUPAC name of triethoxy(henicosyl)silane?
The IUPAC name of triethoxy(henicosyl)silane (CID 141362894) is triethoxy(henicosyl)silane.
What is the SMILES notation for triethoxy(henicosyl)silane?
The canonical SMILES for triethoxy(henicosyl)silane is CCCCCCCCCCCCCCCCCCCCC[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy(henicosyl)silane?
The InChIKey is JEAAMWVFSYAUEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H58O3Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-31(28-6-2,29-7-3)30-8-4/h5-27H2,1-4H3.
What are the key properties of triethoxy(henicosyl)silane?
triethoxy(henicosyl)silane has a molecular weight of 458.84 g/mol, XLogP of 9.47, 26 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(henicosyl)silane is sourced from PubChem (CID 141362894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).