4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane

C5H2F8O — CID 88849043

IUPAC4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane
SMILESFC(F)C1(F)C(F)OC(F)(F)C1(F)F
InChIInChI=1S/C5H2F8O/c6-1(7)3(9)2(8)14-5(12,13)4(3,10)11/h1-2H
InChIKeyJEOBHVANGOUHJG-UHFFFAOYSA-N
MW230.05 g/mol
LogP2.51
Rot. Bonds1

About 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane

4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane (PubChem CID 88849043) has the molecular formula C5H2F8O and a molecular weight of 230.05 g/mol. Its IUPAC name is 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane.

Molecular Properties

Compound Name4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane
PubChem CID88849043
Molecular FormulaC5H2F8O
Molecular Weight230.05 g/mol
Exact Mass230.00
IUPAC Name4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane
SMILESFC(F)C1(F)C(F)OC(F)(F)C1(F)F
InChIInChI=1S/C5H2F8O/c6-1(7)3(9)2(8)14-5(12,13)4(3,10)11/h1-2H
InChIKeyJEOBHVANGOUHJG-UHFFFAOYSA-N
XLogP2.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.05
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10-heptadecafluorooxecane
CID 75360843
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-4a,8a-dihydronaphthalene
CID 21225585
2,2,3,3,4,5,5,6,6-nonafluorooxane
CID 73057419
2,2,3,5,6,6-hexafluoro-1,4-dioxane
CID 74024068
4-(difluoromethyl)-5-fluoro-4-methyl-1,3-dioxolan-2-one
CID 151184122
(4R)-1,1,2,2,3,3,4,5-octafluorocyclopentane
CID 167169999
1,1,2,2,3,3,4,5-octafluorocyclopentane
CID 2778426
1-tert-butyl-1-(difluoromethyl)cyclopropane
CID 121308239
2,2,5-trifluoro-1,3-dioxane
CID 154222537
1,2,2,3,3,4,4,5,5,6-decafluoro-1λ5-phosphinane 1-oxide
CID 87925353
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15-triacontafluorocyclopentadecane
CID 162355786
methane;2,2,3,3-tetrafluorooxirane
CID 174885785

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane?
The IUPAC name of 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane (CID 88849043) is 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane.
What is the SMILES notation for 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane?
The canonical SMILES for 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane is FC(F)C1(F)C(F)OC(F)(F)C1(F)F.
What is the InChIKey of 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane?
The InChIKey is JEOBHVANGOUHJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2F8O/c6-1(7)3(9)2(8)14-5(12,13)4(3,10)11/h1-2H.
What are the key properties of 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane?
4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane has a molecular weight of 230.05 g/mol, XLogP of 2.51, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-2,2,3,3,4,5-hexafluorooxolane is sourced from PubChem (CID 88849043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).