2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol

C10H24O2SSi — CID 58379181

IUPAC2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol
SMILESCC(C)(C)[Si](C)(C)OCCSCCO
InChIInChI=1S/C10H24O2SSi/c1-10(2,3)14(4,5)12-7-9-13-8-6-11/h11H,6-9H2,1-5H3
InChIKeyYQHRUVWCWRUZSV-UHFFFAOYSA-N
MW236.45 g/mol
LogP2.73
Rot. Bonds6

About 2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol

2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol (PubChem CID 58379181) has the molecular formula C10H24O2SSi and a molecular weight of 236.45 g/mol. Its IUPAC name is 2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol.

Molecular Properties

Compound Name2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol
PubChem CID58379181
Molecular FormulaC10H24O2SSi
Molecular Weight236.45 g/mol
Exact Mass236.13
IUPAC Name2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol
SMILESCC(C)(C)[Si](C)(C)OCCSCCO
InChIInChI=1S/C10H24O2SSi/c1-10(2,3)14(4,5)12-7-9-13-8-6-11/h11H,6-9H2,1-5H3
InChIKeyYQHRUVWCWRUZSV-UHFFFAOYSA-N
XLogP2.73
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.45
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol?
The IUPAC name of 2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol (CID 58379181) is 2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol.
What is the SMILES notation for 2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol?
The canonical SMILES for 2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol is CC(C)(C)[Si](C)(C)OCCSCCO.
What is the InChIKey of 2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol?
The InChIKey is YQHRUVWCWRUZSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24O2SSi/c1-10(2,3)14(4,5)12-7-9-13-8-6-11/h11H,6-9H2,1-5H3.
What are the key properties of 2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol?
2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol has a molecular weight of 236.45 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[tert-butyl(dimethyl)silyl]oxyethylsulfanyl]ethanol is sourced from PubChem (CID 58379181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).