2-ethyl-2-fluorooxetane

C5H9FO — CID 91146027

IUPAC2-ethyl-2-fluorooxetane
SMILESCCC1(F)CCO1
InChIInChI=1S/C5H9FO/c1-2-5(6)3-4-7-5/h2-4H2,1H3
InChIKeyZVCCUSDALHWYKE-UHFFFAOYSA-N
MW104.12 g/mol
LogP1.48
Rot. Bonds1

About 2-ethyl-2-fluorooxetane

2-ethyl-2-fluorooxetane (PubChem CID 91146027) has the molecular formula C5H9FO and a molecular weight of 104.12 g/mol. Its IUPAC name is 2-ethyl-2-fluorooxetane.

Molecular Properties

Compound Name2-ethyl-2-fluorooxetane
PubChem CID91146027
Molecular FormulaC5H9FO
Molecular Weight104.12 g/mol
Exact Mass104.06
IUPAC Name2-ethyl-2-fluorooxetane
SMILESCCC1(F)CCO1
InChIInChI=1S/C5H9FO/c1-2-5(6)3-4-7-5/h2-4H2,1H3
InChIKeyZVCCUSDALHWYKE-UHFFFAOYSA-N
XLogP1.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.12
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-fluorooxetane?
The IUPAC name of 2-ethyl-2-fluorooxetane (CID 91146027) is 2-ethyl-2-fluorooxetane.
What is the SMILES notation for 2-ethyl-2-fluorooxetane?
The canonical SMILES for 2-ethyl-2-fluorooxetane is CCC1(F)CCO1.
What is the InChIKey of 2-ethyl-2-fluorooxetane?
The InChIKey is ZVCCUSDALHWYKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9FO/c1-2-5(6)3-4-7-5/h2-4H2,1H3.
What are the key properties of 2-ethyl-2-fluorooxetane?
2-ethyl-2-fluorooxetane has a molecular weight of 104.12 g/mol, XLogP of 1.48, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-fluorooxetane is sourced from PubChem (CID 91146027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).