2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane

C6F12O — CID 13451001

IUPAC2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane
SMILESFC(F)(F)C(F)(F)C1(F)OC(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C6F12O/c7-1(8)2(9,10)6(17,18)19-4(1,13)3(11,12)5(14,15)16
InChIKeyAJYRBQGTPUSTHS-UHFFFAOYSA-N
MW316.04 g/mol
LogP3.74
Rot. Bonds1

About 2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane

2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane (PubChem CID 13451001) has the molecular formula C6F12O and a molecular weight of 316.04 g/mol. Its IUPAC name is 2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane.

Molecular Properties

Compound Name2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane
PubChem CID13451001
Molecular FormulaC6F12O
Molecular Weight316.04 g/mol
Exact Mass315.98
IUPAC Name2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane
SMILESFC(F)(F)C(F)(F)C1(F)OC(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C6F12O/c7-1(8)2(9,10)6(17,18)19-4(1,13)3(11,12)5(14,15)16
InChIKeyAJYRBQGTPUSTHS-UHFFFAOYSA-N
XLogP3.74
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.04
LogP ≤ 53.74
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

2,2,3,3,4,4,5-Heptafluoro-5-(heptafluoropropyl)oxolane
CID 12596616
Caroxin F
CID 15672464
Perfluoro-2-methyloxalane
CID 15091571
(3S,5R)-2,2,3,4,4,5-hexafluoro-5-(1,1,2,2,2-pentafluoroethyl)-3-(trifluoromethyl)oxolane
CID 175884602
Heptafluoro-2-trifluoromethyl-tetrahydro-furan
CID 23236296
2,3,3,4,4,5-Hexafluoro-2-(1,1,2,2,2-pentafluoroethyl)-5-(trifluoromethyl)oxolane
CID 12596609
(3S,5S)-2,2,3,4,4,5-hexafluoro-5-(1,1,2,2,2-pentafluoroethyl)-3-(trifluoromethyl)oxolane
CID 23236428
2-(1,1-Difluoroethyl)-2,3,3,4,4,5,5-heptafluorooxolane
CID 89929858
2,2,3,5-Tetrafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane
CID 118335126
2,2,3,3,4,5-Hexafluoro-5-(1,1,2,2-tetrafluoroethyl)oxolane
CID 173556222
2,3,3,4,4,5-Hexafluoro-2,5-bis(trifluoromethyl)oxolane
CID 13978936
(3R,5S)-2,2,3,4,4,5-hexafluoro-5-(1,1,2,2,2-pentafluoroethyl)-3-(trifluoromethyl)oxolane
CID 23236429

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane?
The IUPAC name of 2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane (CID 13451001) is 2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane.
What is the SMILES notation for 2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane?
The canonical SMILES for 2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane is FC(F)(F)C(F)(F)C1(F)OC(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane?
The InChIKey is AJYRBQGTPUSTHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F12O/c7-1(8)2(9,10)6(17,18)19-4(1,13)3(11,12)5(14,15)16.
What are the key properties of 2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane?
2,2,3,3,4,4,5-heptafluoro-5-(1,1,2,2,2-pentafluoroethyl)oxolane has a molecular weight of 316.04 g/mol, XLogP of 3.74, 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-(1,1,2,2,2-pentafluoroethyl)oxolane is sourced from PubChem (CID 13451001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).