triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane

C11H22OSSi — CID 86072820

IUPACtriethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane
SMILESCC[Si](C#CSCCOC)(CC)CC
InChIInChI=1S/C11H22OSSi/c1-5-14(6-2,7-3)11-10-13-9-8-12-4/h5-9H2,1-4H3
InChIKeyUEBCZECRAAHQNW-UHFFFAOYSA-N
MW230.45 g/mol
LogP3.37
Rot. Bonds6

About triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane

triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane (PubChem CID 86072820) has the molecular formula C11H22OSSi and a molecular weight of 230.45 g/mol. Its IUPAC name is triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane.

Molecular Properties

Compound Nametriethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane
PubChem CID86072820
Molecular FormulaC11H22OSSi
Molecular Weight230.45 g/mol
Exact Mass230.12
IUPAC Nametriethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane
SMILESCC[Si](C#CSCCOC)(CC)CC
InChIInChI=1S/C11H22OSSi/c1-5-14(6-2,7-3)11-10-13-9-8-12-4/h5-9H2,1-4H3
InChIKeyUEBCZECRAAHQNW-UHFFFAOYSA-N
XLogP3.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.45
LogP ≤ 53.37
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'}

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Frequently Asked Questions

What is the IUPAC name of triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane?
The IUPAC name of triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane (CID 86072820) is triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane.
What is the SMILES notation for triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane?
The canonical SMILES for triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane is CC[Si](C#CSCCOC)(CC)CC.
What is the InChIKey of triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane?
The InChIKey is UEBCZECRAAHQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22OSSi/c1-5-14(6-2,7-3)11-10-13-9-8-12-4/h5-9H2,1-4H3.
What are the key properties of triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane?
triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane has a molecular weight of 230.45 g/mol, XLogP of 3.37, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[2-(2-methoxyethylsulfanyl)ethynyl]silane is sourced from PubChem (CID 86072820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).