2-(2-fluoroethylsulfinyl)ethanol

C4H9FO2S — CID 54544917

IUPAC2-(2-fluoroethylsulfinyl)ethanol
SMILESO=S(CCO)CCF
InChIInChI=1S/C4H9FO2S/c5-1-3-8(7)4-2-6/h6H,1-4H2
InChIKeyRWAJOASGODKXGO-UHFFFAOYSA-N
MW140.18 g/mol
LogP-0.30
Rot. Bonds4

About 2-(2-fluoroethylsulfinyl)ethanol

2-(2-fluoroethylsulfinyl)ethanol (PubChem CID 54544917) has the molecular formula C4H9FO2S and a molecular weight of 140.18 g/mol. Its IUPAC name is 2-(2-fluoroethylsulfinyl)ethanol.

Molecular Properties

Compound Name2-(2-fluoroethylsulfinyl)ethanol
PubChem CID54544917
Molecular FormulaC4H9FO2S
Molecular Weight140.18 g/mol
Exact Mass140.03
IUPAC Name2-(2-fluoroethylsulfinyl)ethanol
SMILESO=S(CCO)CCF
InChIInChI=1S/C4H9FO2S/c5-1-3-8(7)4-2-6/h6H,1-4H2
InChIKeyRWAJOASGODKXGO-UHFFFAOYSA-N
XLogP-0.30
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.18
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoroethylsulfinyl)ethanol?
The IUPAC name of 2-(2-fluoroethylsulfinyl)ethanol (CID 54544917) is 2-(2-fluoroethylsulfinyl)ethanol.
What is the SMILES notation for 2-(2-fluoroethylsulfinyl)ethanol?
The canonical SMILES for 2-(2-fluoroethylsulfinyl)ethanol is O=S(CCO)CCF.
What is the InChIKey of 2-(2-fluoroethylsulfinyl)ethanol?
The InChIKey is RWAJOASGODKXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9FO2S/c5-1-3-8(7)4-2-6/h6H,1-4H2.
What are the key properties of 2-(2-fluoroethylsulfinyl)ethanol?
2-(2-fluoroethylsulfinyl)ethanol has a molecular weight of 140.18 g/mol, XLogP of -0.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoroethylsulfinyl)ethanol is sourced from PubChem (CID 54544917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).