2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane

C8H10F6O — CID 20802273

IUPAC2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane
SMILESCCC1(F)OC(F)(F)C(F)(F)C1(F)CC
InChIInChI=1S/C8H10F6O/c1-3-5(9)6(10,4-2)15-8(13,14)7(5,11)12/h3-4H2,1-2H3
InChIKeyDNKPCTFYJUTUOK-UHFFFAOYSA-N
MW236.15 g/mol
LogP3.44
Rot. Bonds2

About 2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane

2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane (PubChem CID 20802273) has the molecular formula C8H10F6O and a molecular weight of 236.15 g/mol. Its IUPAC name is 2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane.

Molecular Properties

Compound Name2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane
PubChem CID20802273
Molecular FormulaC8H10F6O
Molecular Weight236.15 g/mol
Exact Mass236.06
IUPAC Name2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane
SMILESCCC1(F)OC(F)(F)C(F)(F)C1(F)CC
InChIInChI=1S/C8H10F6O/c1-3-5(9)6(10,4-2)15-8(13,14)7(5,11)12/h3-4H2,1-2H3
InChIKeyDNKPCTFYJUTUOK-UHFFFAOYSA-N
XLogP3.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.15
LogP ≤ 53.44
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

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-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
2-(1,1-Difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane
CID 58473338

Frequently Asked Questions

What is the IUPAC name of 2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane?
The IUPAC name of 2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane (CID 20802273) is 2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane.
What is the SMILES notation for 2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane?
The canonical SMILES for 2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane is CCC1(F)OC(F)(F)C(F)(F)C1(F)CC.
What is the InChIKey of 2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane?
The InChIKey is DNKPCTFYJUTUOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F6O/c1-3-5(9)6(10,4-2)15-8(13,14)7(5,11)12/h3-4H2,1-2H3.
What are the key properties of 2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane?
2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane has a molecular weight of 236.15 g/mol, XLogP of 3.44, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diethyl-2,3,4,4,5,5-hexafluorooxolane is sourced from PubChem (CID 20802273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).