triethoxy(2,2,4-trimethylpentyl)silane

C14H32O3Si — CID 21480871

IUPACtriethoxy(2,2,4-trimethylpentyl)silane
SMILESCCO[Si](CC(C)(C)CC(C)C)(OCC)OCC
InChIInChI=1S/C14H32O3Si/c1-8-15-18(16-9-2,17-10-3)12-14(6,7)11-13(4)5/h13H,8-12H2,1-7H3
InChIKeyDHEOLHWDNNLCNQ-UHFFFAOYSA-N
MW276.49 g/mol
LogP4.11
Rot. Bonds10

About triethoxy(2,2,4-trimethylpentyl)silane

triethoxy(2,2,4-trimethylpentyl)silane (PubChem CID 21480871) has the molecular formula C14H32O3Si and a molecular weight of 276.49 g/mol. Its IUPAC name is triethoxy(2,2,4-trimethylpentyl)silane.

Molecular Properties

Compound Nametriethoxy(2,2,4-trimethylpentyl)silane
PubChem CID21480871
Molecular FormulaC14H32O3Si
Molecular Weight276.49 g/mol
Exact Mass276.21
IUPAC Nametriethoxy(2,2,4-trimethylpentyl)silane
SMILESCCO[Si](CC(C)(C)CC(C)C)(OCC)OCC
InChIInChI=1S/C14H32O3Si/c1-8-15-18(16-9-2,17-10-3)12-14(6,7)11-13(4)5/h13H,8-12H2,1-7H3
InChIKeyDHEOLHWDNNLCNQ-UHFFFAOYSA-N
XLogP4.11
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.49
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze triethoxy(2,2,4-trimethylpentyl)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 triethoxy(2,2,4-trimethylpentyl)silane?
The IUPAC name of triethoxy(2,2,4-trimethylpentyl)silane (CID 21480871) is triethoxy(2,2,4-trimethylpentyl)silane.
What is the SMILES notation for triethoxy(2,2,4-trimethylpentyl)silane?
The canonical SMILES for triethoxy(2,2,4-trimethylpentyl)silane is CCO[Si](CC(C)(C)CC(C)C)(OCC)OCC.
What is the InChIKey of triethoxy(2,2,4-trimethylpentyl)silane?
The InChIKey is DHEOLHWDNNLCNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O3Si/c1-8-15-18(16-9-2,17-10-3)12-14(6,7)11-13(4)5/h13H,8-12H2,1-7H3.
What are the key properties of triethoxy(2,2,4-trimethylpentyl)silane?
triethoxy(2,2,4-trimethylpentyl)silane has a molecular weight of 276.49 g/mol, XLogP of 4.11, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(2,2,4-trimethylpentyl)silane is sourced from PubChem (CID 21480871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).