3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene

C8F14 — CID 12808573

IUPAC3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene
SMILESFC(F)(F)C1=C(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C8F14/c9-3(10)1(5(13,14)8(20,21)22)2(6(15,16)17)4(11,12)7(3,18)19
InChIKeyDUKLVWYBSAUHAB-UHFFFAOYSA-N
MW362.06 g/mol
LogP4.96
Rot. Bonds1

About 3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene

3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene (PubChem CID 12808573) has the molecular formula C8F14 and a molecular weight of 362.06 g/mol. Its IUPAC name is 3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene.

Molecular Properties

Compound Name3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene
PubChem CID12808573
Molecular FormulaC8F14
Molecular Weight362.06 g/mol
Exact Mass361.98
IUPAC Name3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene
SMILESFC(F)(F)C1=C(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C8F14/c9-3(10)1(5(13,14)8(20,21)22)2(6(15,16)17)4(11,12)7(3,18)19
InChIKeyDUKLVWYBSAUHAB-UHFFFAOYSA-N
XLogP4.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.06
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,3,3,4,4,5,5-Heptafluoro-2-(trifluoromethyl)cyclopent-1-ene
CID 2774954
Perfluoro-1-methyl-2-(2-methyl-1-cyclopentenyl) cyclopentene
CID 12661372
Perfluoro-2,3-dimethyl-4,5,6,7-tetrahydroindene
CID 15628706
Cyclohexene, 1,3,3,4,4,5,5,6,6-nonafluoro-2-(pentafluoroethyl)-
CID 10926524
1,3,3,4,4,5,5-Heptafluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)cyclopentene
CID 12563817
3,3,4,4,5,5-Hexafluoro-1,2-bis(trifluoromethyl)cyclopent-1-ene
CID 13197615
3,3,4,4-Tetrafluoro-1,2-bis(1,1,2,2,2-pentafluoroethyl)cyclobutene
CID 14249323
Perfluorobi(cyclopentene)
CID 11395047
Perfluoro-2-methyl-3-ethyl-4,5,6,7-tetrahydroindene
CID 129750405
Perfluoro-2-methyl-3-propyl-2-pentene
CID 129812313
Perfluorooctyl-5-methyl-hex-2-ene
CID 129829873
Perfluoro(1,2-dipropylcyclohexene)
CID 550354

Frequently Asked Questions

What is the IUPAC name of 3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene?
The IUPAC name of 3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene (CID 12808573) is 3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene.
What is the SMILES notation for 3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene?
The canonical SMILES for 3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene is FC(F)(F)C1=C(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene?
The InChIKey is DUKLVWYBSAUHAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8F14/c9-3(10)1(5(13,14)8(20,21)22)2(6(15,16)17)4(11,12)7(3,18)19.
What are the key properties of 3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene?
3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene has a molecular weight of 362.06 g/mol, XLogP of 4.96, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,4,4,5,5-hexafluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)cyclopentene is sourced from PubChem (CID 12808573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).