2-fluoro-2-(thiolan-2-yl)ethanol

C6H11FOS — CID 105429479

IUPAC2-fluoro-2-(thiolan-2-yl)ethanol
SMILESOCC(F)C1CCCS1
InChIInChI=1S/C6H11FOS/c7-5(4-8)6-2-1-3-9-6/h5-6,8H,1-4H2
InChIKeyOGQZMVGRXCTTAN-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.21
Rot. Bonds2

About 2-fluoro-2-(thiolan-2-yl)ethanol

2-fluoro-2-(thiolan-2-yl)ethanol (PubChem CID 105429479) has the molecular formula C6H11FOS and a molecular weight of 150.22 g/mol. Its IUPAC name is 2-fluoro-2-(thiolan-2-yl)ethanol.

Molecular Properties

Compound Name2-fluoro-2-(thiolan-2-yl)ethanol
PubChem CID105429479
Molecular FormulaC6H11FOS
Molecular Weight150.22 g/mol
Exact Mass150.05
IUPAC Name2-fluoro-2-(thiolan-2-yl)ethanol
SMILESOCC(F)C1CCCS1
InChIInChI=1S/C6H11FOS/c7-5(4-8)6-2-1-3-9-6/h5-6,8H,1-4H2
InChIKeyOGQZMVGRXCTTAN-UHFFFAOYSA-N
XLogP1.21
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-(thiolan-2-yl)ethanol?
The IUPAC name of 2-fluoro-2-(thiolan-2-yl)ethanol (CID 105429479) is 2-fluoro-2-(thiolan-2-yl)ethanol.
What is the SMILES notation for 2-fluoro-2-(thiolan-2-yl)ethanol?
The canonical SMILES for 2-fluoro-2-(thiolan-2-yl)ethanol is OCC(F)C1CCCS1.
What is the InChIKey of 2-fluoro-2-(thiolan-2-yl)ethanol?
The InChIKey is OGQZMVGRXCTTAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11FOS/c7-5(4-8)6-2-1-3-9-6/h5-6,8H,1-4H2.
What are the key properties of 2-fluoro-2-(thiolan-2-yl)ethanol?
2-fluoro-2-(thiolan-2-yl)ethanol has a molecular weight of 150.22 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-(thiolan-2-yl)ethanol is sourced from PubChem (CID 105429479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).