2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol

C7H18O2SSi — CID 140737423

IUPAC2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol
SMILESCO[Si](C)(C)C(C)SCCO
InChIInChI=1S/C7H18O2SSi/c1-7(10-6-5-8)11(3,4)9-2/h7-8H,5-6H2,1-4H3
InChIKeyBLTIJHBZBIQLEV-UHFFFAOYSA-N
MW194.37 g/mol
LogP1.49
Rot. Bonds5

About 2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol

2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol (PubChem CID 140737423) has the molecular formula C7H18O2SSi and a molecular weight of 194.37 g/mol. Its IUPAC name is 2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol.

Molecular Properties

Compound Name2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol
PubChem CID140737423
Molecular FormulaC7H18O2SSi
Molecular Weight194.37 g/mol
Exact Mass194.08
IUPAC Name2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol
SMILESCO[Si](C)(C)C(C)SCCO
InChIInChI=1S/C7H18O2SSi/c1-7(10-6-5-8)11(3,4)9-2/h7-8H,5-6H2,1-4H3
InChIKeyBLTIJHBZBIQLEV-UHFFFAOYSA-N
XLogP1.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.37
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol?
The IUPAC name of 2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol (CID 140737423) is 2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol.
What is the SMILES notation for 2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol?
The canonical SMILES for 2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol is CO[Si](C)(C)C(C)SCCO.
What is the InChIKey of 2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol?
The InChIKey is BLTIJHBZBIQLEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O2SSi/c1-7(10-6-5-8)11(3,4)9-2/h7-8H,5-6H2,1-4H3.
What are the key properties of 2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol?
2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol has a molecular weight of 194.37 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[methoxy(dimethyl)silyl]ethylsulfanyl]ethanol is sourced from PubChem (CID 140737423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).