triethoxy-(3-ethyl-2-methylpentyl)silane

C14H32O3Si — CID 18696416

IUPACtriethoxy-(3-ethyl-2-methylpentyl)silane
SMILESCCO[Si](CC(C)C(CC)CC)(OCC)OCC
InChIInChI=1S/C14H32O3Si/c1-7-14(8-2)13(6)12-18(15-9-3,16-10-4)17-11-5/h13-14H,7-12H2,1-6H3
InChIKeyLRCOTRWTXIXOHA-UHFFFAOYSA-N
MW276.49 g/mol
LogP4.11
Rot. Bonds11

About triethoxy-(3-ethyl-2-methylpentyl)silane

triethoxy-(3-ethyl-2-methylpentyl)silane (PubChem CID 18696416) has the molecular formula C14H32O3Si and a molecular weight of 276.49 g/mol. Its IUPAC name is triethoxy-(3-ethyl-2-methylpentyl)silane.

Molecular Properties

Compound Nametriethoxy-(3-ethyl-2-methylpentyl)silane
PubChem CID18696416
Molecular FormulaC14H32O3Si
Molecular Weight276.49 g/mol
Exact Mass276.21
IUPAC Nametriethoxy-(3-ethyl-2-methylpentyl)silane
SMILESCCO[Si](CC(C)C(CC)CC)(OCC)OCC
InChIInChI=1S/C14H32O3Si/c1-7-14(8-2)13(6)12-18(15-9-3,16-10-4)17-11-5/h13-14H,7-12H2,1-6H3
InChIKeyLRCOTRWTXIXOHA-UHFFFAOYSA-N
XLogP4.11
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
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-(3-ethyl-2-methylpentyl)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-(3-ethyl-2-methylpentyl)silane?
The IUPAC name of triethoxy-(3-ethyl-2-methylpentyl)silane (CID 18696416) is triethoxy-(3-ethyl-2-methylpentyl)silane.
What is the SMILES notation for triethoxy-(3-ethyl-2-methylpentyl)silane?
The canonical SMILES for triethoxy-(3-ethyl-2-methylpentyl)silane is CCO[Si](CC(C)C(CC)CC)(OCC)OCC.
What is the InChIKey of triethoxy-(3-ethyl-2-methylpentyl)silane?
The InChIKey is LRCOTRWTXIXOHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O3Si/c1-7-14(8-2)13(6)12-18(15-9-3,16-10-4)17-11-5/h13-14H,7-12H2,1-6H3.
What are the key properties of triethoxy-(3-ethyl-2-methylpentyl)silane?
triethoxy-(3-ethyl-2-methylpentyl)silane has a molecular weight of 276.49 g/mol, XLogP of 4.11, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-(3-ethyl-2-methylpentyl)silane is sourced from PubChem (CID 18696416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).