2,2,3,3,5,5-hexafluorooxolane

C4H2F6O — CID 18737303

IUPAC2,2,3,3,5,5-hexafluorooxolane
SMILESFC1(F)CC(F)(F)C(F)(F)O1
InChIInChI=1S/C4H2F6O/c5-2(6)1-3(7,8)11-4(2,9)10/h1H2
InChIKeyZHOZBHVMRNURJZ-UHFFFAOYSA-N
MW180.05 g/mol
LogP2.23
Rot. Bonds

About 2,2,3,3,5,5-hexafluorooxolane

2,2,3,3,5,5-hexafluorooxolane (PubChem CID 18737303) has the molecular formula C4H2F6O and a molecular weight of 180.05 g/mol. Its IUPAC name is 2,2,3,3,5,5-hexafluorooxolane.

Molecular Properties

Compound Name2,2,3,3,5,5-hexafluorooxolane
PubChem CID18737303
Molecular FormulaC4H2F6O
Molecular Weight180.05 g/mol
Exact Mass180.00
IUPAC Name2,2,3,3,5,5-hexafluorooxolane
SMILESFC1(F)CC(F)(F)C(F)(F)O1
InChIInChI=1S/C4H2F6O/c5-2(6)1-3(7,8)11-4(2,9)10/h1H2
InChIKeyZHOZBHVMRNURJZ-UHFFFAOYSA-N
XLogP2.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.05
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(1,1-difluoroethyl)-2,3,3,5,5-pentafluorooxolane
CID 20700669
2,2,3,3,5,5-hexafluoro-1,4-dioxane
CID 11194916
2,2,3,3,10,10,11,11-octafluoro-oxacycloundecane
CID 161268792
methane;2,2,3,3-tetrafluorooxirane
CID 174885785
2,2-difluorooxirane
CID 19829575
2,2,3-trifluoro-3-methyloxirane
CID 22289961
1,1-dichloro-2,2-difluorocyclopropane
CID 12637093
2,2,4,4,5,5,7,7,8,8,10,10,11,11,13,13,14,14,16,16,17,17,19,19,20,20-hexacosafluoro-1,3,6,9,12,15,18-heptaoxacycloicosane
CID 86282027
3,3,4,4-tetrafluorooxolane
CID 2782427
3,3,6,6-tetrafluorodioxane
CID 45090701
2,2,3,3-tetrafluoro-1,4-dioxane
CID 12581607
1,3-difluorobicyclo[1.1.1]pentane
CID 86129482

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,5,5-hexafluorooxolane?
The IUPAC name of 2,2,3,3,5,5-hexafluorooxolane (CID 18737303) is 2,2,3,3,5,5-hexafluorooxolane.
What is the SMILES notation for 2,2,3,3,5,5-hexafluorooxolane?
The canonical SMILES for 2,2,3,3,5,5-hexafluorooxolane is FC1(F)CC(F)(F)C(F)(F)O1.
What is the InChIKey of 2,2,3,3,5,5-hexafluorooxolane?
The InChIKey is ZHOZBHVMRNURJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2F6O/c5-2(6)1-3(7,8)11-4(2,9)10/h1H2.
What are the key properties of 2,2,3,3,5,5-hexafluorooxolane?
2,2,3,3,5,5-hexafluorooxolane has a molecular weight of 180.05 g/mol, XLogP of 2.23, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3,5,5-hexafluorooxolane is sourced from PubChem (CID 18737303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).