2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane

C10H2F16O2 — CID 567944

IUPAC2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane
SMILESFC1(F)OC(C(F)(F)C(F)(F)C2OC(F)(F)C(F)(F)C2(F)F)C(F)(F)C1(F)F
InChIInChI=1S/C10H2F16O2/c11-3(12,1-5(15,16)7(19,20)9(23,24)27-1)4(13,14)2-6(17,18)8(21,22)10(25,26)28-2/h1-2H
InChIKeyBOOFLOHUYFPBKD-UHFFFAOYSA-N
MW458.09 g/mol
LogP4.78
Rot. Bonds3

About 2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane

2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane (PubChem CID 567944) has the molecular formula C10H2F16O2 and a molecular weight of 458.09 g/mol. Its IUPAC name is 2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane.

Molecular Properties

Compound Name2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane
PubChem CID567944
Molecular FormulaC10H2F16O2
Molecular Weight458.09 g/mol
Exact Mass457.98
IUPAC Name2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane
SMILESFC1(F)OC(C(F)(F)C(F)(F)C2OC(F)(F)C(F)(F)C2(F)F)C(F)(F)C1(F)F
InChIInChI=1S/C10H2F16O2/c11-3(12,1-5(15,16)7(19,20)9(23,24)27-1)4(13,14)2-6(17,18)8(21,22)10(25,26)28-2/h1-2H
InChIKeyBOOFLOHUYFPBKD-UHFFFAOYSA-N
XLogP4.78
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.09
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane?
The IUPAC name of 2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane (CID 567944) is 2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane.
What is the SMILES notation for 2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane?
The canonical SMILES for 2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane is FC1(F)OC(C(F)(F)C(F)(F)C2OC(F)(F)C(F)(F)C2(F)F)C(F)(F)C1(F)F.
What is the InChIKey of 2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane?
The InChIKey is BOOFLOHUYFPBKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H2F16O2/c11-3(12,1-5(15,16)7(19,20)9(23,24)27-1)4(13,14)2-6(17,18)8(21,22)10(25,26)28-2/h1-2H.
What are the key properties of 2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane?
2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane has a molecular weight of 458.09 g/mol, XLogP of 4.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3,4,4-hexafluoro-5-[1,1,2,2-tetrafluoro-2-(3,3,4,4,5,5-hexafluorooxolan-2-yl)ethyl]oxolane is sourced from PubChem (CID 567944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).