2-(2-trimethoxysilylethylsulfanyl)ethanol

C7H18O4SSi — CID 71335611

IUPAC2-(2-trimethoxysilylethylsulfanyl)ethanol
SMILESCO[Si](CCSCCO)(OC)OC
InChIInChI=1S/C7H18O4SSi/c1-9-13(10-2,11-3)7-6-12-5-4-8/h8H,4-7H2,1-3H3
InChIKeyFFYNJSBDCUIZRM-UHFFFAOYSA-N
MW226.37 g/mol
LogP0.59
Rot. Bonds8

About 2-(2-trimethoxysilylethylsulfanyl)ethanol

2-(2-trimethoxysilylethylsulfanyl)ethanol (PubChem CID 71335611) has the molecular formula C7H18O4SSi and a molecular weight of 226.37 g/mol. Its IUPAC name is 2-(2-trimethoxysilylethylsulfanyl)ethanol.

Molecular Properties

Compound Name2-(2-trimethoxysilylethylsulfanyl)ethanol
PubChem CID71335611
Molecular FormulaC7H18O4SSi
Molecular Weight226.37 g/mol
Exact Mass226.07
IUPAC Name2-(2-trimethoxysilylethylsulfanyl)ethanol
SMILESCO[Si](CCSCCO)(OC)OC
InChIInChI=1S/C7H18O4SSi/c1-9-13(10-2,11-3)7-6-12-5-4-8/h8H,4-7H2,1-3H3
InChIKeyFFYNJSBDCUIZRM-UHFFFAOYSA-N
XLogP0.59
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.37
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-trimethoxysilylethylsulfanyl)ethanol?
The IUPAC name of 2-(2-trimethoxysilylethylsulfanyl)ethanol (CID 71335611) is 2-(2-trimethoxysilylethylsulfanyl)ethanol.
What is the SMILES notation for 2-(2-trimethoxysilylethylsulfanyl)ethanol?
The canonical SMILES for 2-(2-trimethoxysilylethylsulfanyl)ethanol is CO[Si](CCSCCO)(OC)OC.
What is the InChIKey of 2-(2-trimethoxysilylethylsulfanyl)ethanol?
The InChIKey is FFYNJSBDCUIZRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O4SSi/c1-9-13(10-2,11-3)7-6-12-5-4-8/h8H,4-7H2,1-3H3.
What are the key properties of 2-(2-trimethoxysilylethylsulfanyl)ethanol?
2-(2-trimethoxysilylethylsulfanyl)ethanol has a molecular weight of 226.37 g/mol, XLogP of 0.59, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-trimethoxysilylethylsulfanyl)ethanol is sourced from PubChem (CID 71335611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).