1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene

C7H2F10O — CID 155670543

IUPAC1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene
SMILESFC1=C(OCC(F)(F)F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C7H2F10O/c8-2-3(18-1-4(9,10)11)6(14,15)7(16,17)5(2,12)13/h1H2
InChIKeyXCAIJQXYINIZQX-UHFFFAOYSA-N
MW292.07 g/mol
LogP3.67
Rot. Bonds2

About 1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene

1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene (PubChem CID 155670543) has the molecular formula C7H2F10O and a molecular weight of 292.07 g/mol. Its IUPAC name is 1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene.

Molecular Properties

Compound Name1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene
PubChem CID155670543
Molecular FormulaC7H2F10O
Molecular Weight292.07 g/mol
Exact Mass291.99
IUPAC Name1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene
SMILESFC1=C(OCC(F)(F)F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C7H2F10O/c8-2-3(18-1-4(9,10)11)6(14,15)7(16,17)5(2,12)13/h1H2
InChIKeyXCAIJQXYINIZQX-UHFFFAOYSA-N
XLogP3.67
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.07
LogP ≤ 53.67
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

1,3,3,4,4,5,5-Heptafluoro-2-methoxycyclopentene
CID 74476
Cyclohexene, 1-(2,2,2-trifluoroethoxy)nonafluoro-
CID 75376
1-Ethoxy-2,3,3,4,4,5,5-heptafluorocyclopent-1-ene
CID 17906083
(E)-1,1,1,2,2,3,5,5,6,6,7,7,8,8,8-pentadecafluoro-4-(2,2,3,3-tetrafluoropropoxy)oct-3-ene
CID 89614750
(E)-1,1,1,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-2-(2,2,3,3-tetrafluoropropoxy)oct-2-ene
CID 89615053
(Z)-1,1,1,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-2-(2,2,3,3-tetrafluoropropoxy)oct-2-ene
CID 89615211
1,3,3,4,4,5,5-Heptafluoro-2-prop-2-ynoxycyclopentene
CID 122554596
1,3,3,4,4,5,5-Heptafluoro-2-[2,2,3,3-tetrafluoro-4-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)oxybutoxy]cyclopentene
CID 134238175
1-Ethoxy-3,3,4,4,5,5-hexafluorocyclopentene
CID 140227295
3,3,4,4,5,5-Hexafluoro-1-(2,2,2-trifluoroethoxy)cyclopentene
CID 140227297
(E)-1,1,1,2,2,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-3-(2,2,3,3-tetrafluoropropoxy)oct-3-ene
CID 145590566
1-Ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium
CID 147732617

Frequently Asked Questions

What is the IUPAC name of 1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene?
The IUPAC name of 1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene (CID 155670543) is 1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene.
What is the SMILES notation for 1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene?
The canonical SMILES for 1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene is FC1=C(OCC(F)(F)F)C(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene?
The InChIKey is XCAIJQXYINIZQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2F10O/c8-2-3(18-1-4(9,10)11)6(14,15)7(16,17)5(2,12)13/h1H2.
What are the key properties of 1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene?
1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene has a molecular weight of 292.07 g/mol, XLogP of 3.67, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3,4,4,5,5-heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene is sourced from PubChem (CID 155670543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).