tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane

C14H28O2Si — CID 23537922

IUPACtert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane
SMILESC#CCCCCOCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H28O2Si/c1-7-8-9-10-11-15-12-13-16-17(5,6)14(2,3)4/h1H,8-13H2,2-6H3
InChIKeyNMUMUSYXPGMLCA-UHFFFAOYSA-N
MW256.46 g/mol
LogP3.83
Rot. Bonds8

About tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane

tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane (PubChem CID 23537922) has the molecular formula C14H28O2Si and a molecular weight of 256.46 g/mol. Its IUPAC name is tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane
PubChem CID23537922
Molecular FormulaC14H28O2Si
Molecular Weight256.46 g/mol
Exact Mass256.19
IUPAC Nametert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane
SMILESC#CCCCCOCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H28O2Si/c1-7-8-9-10-11-15-12-13-16-17(5,6)14(2,3)4/h1H,8-13H2,2-6H3
InChIKeyNMUMUSYXPGMLCA-UHFFFAOYSA-N
XLogP3.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.46
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane 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 tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane (CID 23537922) is tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane is C#CCCCCOCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane?
The InChIKey is NMUMUSYXPGMLCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2Si/c1-7-8-9-10-11-15-12-13-16-17(5,6)14(2,3)4/h1H,8-13H2,2-6H3.
What are the key properties of tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane?
tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane has a molecular weight of 256.46 g/mol, XLogP of 3.83, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(2-hex-5-ynoxyethoxy)-dimethylsilane is sourced from PubChem (CID 23537922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).