2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane

C8H8F8O — CID 58571395

IUPAC2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane
SMILESCCC1(F)C(F)(F)C(F)(F)OC1(F)C(C)(F)F
InChIInChI=1S/C8H8F8O/c1-3-5(11)6(12,13)8(15,16)17-7(5,14)4(2,9)10/h3H2,1-2H3
InChIKeyZKSKWLYHNYXWAY-UHFFFAOYSA-N
MW272.13 g/mol
LogP3.68
Rot. Bonds2

About 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane

2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane (PubChem CID 58571395) has the molecular formula C8H8F8O and a molecular weight of 272.13 g/mol. Its IUPAC name is 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane.

Molecular Properties

Compound Name2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane
PubChem CID58571395
Molecular FormulaC8H8F8O
Molecular Weight272.13 g/mol
Exact Mass272.04
IUPAC Name2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane
SMILESCCC1(F)C(F)(F)C(F)(F)OC1(F)C(C)(F)F
InChIInChI=1S/C8H8F8O/c1-3-5(11)6(12,13)8(15,16)17-7(5,14)4(2,9)10/h3H2,1-2H3
InChIKeyZKSKWLYHNYXWAY-UHFFFAOYSA-N
XLogP3.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.13
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-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

3-Butyl-2,2,3,4,4,5,5-heptafluorooxolane
CID 15788982
3-(1,1-Difluoroethyl)-2,2,3,4,4,6-hexafluoro-6-methyloxane
CID 20700672
5-Ethyl-2,2,3,3,5-pentafluoro-4-(fluoromethyl)oxolane
CID 20725476
4,5-Bis(1,1-difluoroethyl)-2,3,3-trifluoro-2-(trifluoromethyl)oxolane
CID 20738948
5-(1,1-Difluoroethyl)-2,2,5-trifluoro-3-(fluoromethyl)oxolane
CID 20793160
2,3-Diethyl-2,3,4,4,5,5-hexafluorooxolane
CID 20802273
2,3-Bis(1,1-difluoroethyl)-2,3,4,4,5,5-hexafluorooxolane
CID 20823501
2,4-Diethyl-2,3,3,4,5,5-hexafluorooxolane
CID 21397503
1-Ethoxy-1,1,2,2,3,4,4,5,5-nonafluoro-3-(trifluoromethyl)hexane
CID 22088870
2-[Difluoro(1,1,2-trifluoroethoxy)methyl]-1,1,1-trifluoro-4-(trifluoromethyl)hexane;fluoromethane
CID 54203988
2-[Difluoro(1,1,2-trifluoroethoxy)methyl]-1,1,1-trifluoro-4-(trifluoromethyl)hexane
CID 54203989
2-Ethyl-2,3,4,4,5,5-hexafluoro-3-(fluoromethyl)oxolane
CID 57549742

Frequently Asked Questions

What is the IUPAC name of 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane?
The IUPAC name of 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane (CID 58571395) is 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane.
What is the SMILES notation for 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane?
The canonical SMILES for 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane is CCC1(F)C(F)(F)C(F)(F)OC1(F)C(C)(F)F.
What is the InChIKey of 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane?
The InChIKey is ZKSKWLYHNYXWAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F8O/c1-3-5(11)6(12,13)8(15,16)17-7(5,14)4(2,9)10/h3H2,1-2H3.
What are the key properties of 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane?
2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane has a molecular weight of 272.13 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane is sourced from PubChem (CID 58571395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).