4-fluorooxolan-2-one

C4H5FO2 — CID 11480406

IUPAC4-fluorooxolan-2-one
SMILESO=C1CC(F)CO1
InChIInChI=1S/C4H5FO2/c5-3-1-4(6)7-2-3/h3H,1-2H2
InChIKeyHEFOXLVMKSVUQQ-UHFFFAOYSA-N
MW104.08 g/mol
LogP0.27
Rot. Bonds

About 4-fluorooxolan-2-one

4-fluorooxolan-2-one (PubChem CID 11480406) has the molecular formula C4H5FO2 and a molecular weight of 104.08 g/mol. Its IUPAC name is 4-fluorooxolan-2-one.

Molecular Properties

Compound Name4-fluorooxolan-2-one
PubChem CID11480406
Molecular FormulaC4H5FO2
Molecular Weight104.08 g/mol
Exact Mass104.03
IUPAC Name4-fluorooxolan-2-one
SMILESO=C1CC(F)CO1
InChIInChI=1S/C4H5FO2/c5-3-1-4(6)7-2-3/h3H,1-2H2
InChIKeyHEFOXLVMKSVUQQ-UHFFFAOYSA-N
XLogP0.27
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.08
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluorooxolan-2-one?
The IUPAC name of 4-fluorooxolan-2-one (CID 11480406) is 4-fluorooxolan-2-one.
What is the SMILES notation for 4-fluorooxolan-2-one?
The canonical SMILES for 4-fluorooxolan-2-one is O=C1CC(F)CO1.
What is the InChIKey of 4-fluorooxolan-2-one?
The InChIKey is HEFOXLVMKSVUQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5FO2/c5-3-1-4(6)7-2-3/h3H,1-2H2.
What are the key properties of 4-fluorooxolan-2-one?
4-fluorooxolan-2-one has a molecular weight of 104.08 g/mol, XLogP of 0.27, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluorooxolan-2-one is sourced from PubChem (CID 11480406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).