2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane

C5H2F8O — CID 58767914

IUPAC2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane
SMILESFCC1(F)OC(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C5H2F8O/c6-1-2(7)3(8,9)4(10,11)5(12,13)14-2/h1H2
InChIKeyMIUJLUUAYAEOBR-UHFFFAOYSA-N
MW230.05 g/mol
LogP2.52
Rot. Bonds1

About 2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane

2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane (PubChem CID 58767914) has the molecular formula C5H2F8O and a molecular weight of 230.05 g/mol. Its IUPAC name is 2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane.

Molecular Properties

Compound Name2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane
PubChem CID58767914
Molecular FormulaC5H2F8O
Molecular Weight230.05 g/mol
Exact Mass230.00
IUPAC Name2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane
SMILESFCC1(F)OC(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C5H2F8O/c6-1-2(7)3(8,9)4(10,11)5(12,13)14-2/h1H2
InChIKeyMIUJLUUAYAEOBR-UHFFFAOYSA-N
XLogP2.52
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 ≤ 52.52
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

Perfluoro-2-methyloxalane
CID 15091571
Furan, 2-(difluoromethyl)-2,3,3,4,4,5,5-heptafluorotetrahydro-
CID 10681972
2,2,3,5,5-Pentafluorooxolane
CID 12583894
(4S,5S)-2,2,3,3,4,5-hexafluoro-5-(trifluoromethyl)oxolane
CID 175928451
Heptafluoro-2-trifluoromethyl-tetrahydro-furan
CID 23236296
(3S,4R)-2,2,3,4,5,5-hexafluorooxolane
CID 12663921
(3S,4S)-2,2,3,4,5,5-hexafluorooxolane
CID 23234832
(4R,5S)-2,2,3,3,4,5-hexafluoro-5-(trifluoromethyl)oxolane
CID 73057418
2,2,3,4,5,5-Hexafluorotetrahydrofuran
CID 11275371
1,1,1,2,2,3,3,4,4,5,5-Undecafluoro-5-(1,1,2,2-tetrafluoroethoxy)pentane
CID 14832369
(4S,5R)-2,2,3,3,4,5-hexafluoro-5-(trifluoromethyl)oxolane
CID 15717481
2,2,3,3,5,5-Hexafluorooxolane
CID 18737303

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane?
The IUPAC name of 2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane (CID 58767914) is 2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane.
What is the SMILES notation for 2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane?
The canonical SMILES for 2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane is FCC1(F)OC(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane?
The InChIKey is MIUJLUUAYAEOBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2F8O/c6-1-2(7)3(8,9)4(10,11)5(12,13)14-2/h1H2.
What are the key properties of 2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane?
2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane has a molecular weight of 230.05 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3,4,4,5-heptafluoro-5-(fluoromethyl)oxolane is sourced from PubChem (CID 58767914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).