1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene

C8H5F9O — CID 175337705

IUPAC1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene
SMILESFC1=C(OCC(F)(F)C(F)F)C(F)(F)C(F)(F)C1
InChIInChI=1S/C8H5F9O/c9-3-1-7(14,15)8(16,17)4(3)18-2-6(12,13)5(10)11/h5H,1-2H2
InChIKeyZEWKKGSPBQAVRN-UHFFFAOYSA-N
MW288.11 g/mol
LogP3.76
Rot. Bonds4

About 1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene

1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene (PubChem CID 175337705) has the molecular formula C8H5F9O and a molecular weight of 288.11 g/mol. Its IUPAC name is 1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene.

Molecular Properties

Compound Name1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene
PubChem CID175337705
Molecular FormulaC8H5F9O
Molecular Weight288.11 g/mol
Exact Mass288.02
IUPAC Name1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene
SMILESFC1=C(OCC(F)(F)C(F)F)C(F)(F)C(F)(F)C1
InChIInChI=1S/C8H5F9O/c9-3-1-7(14,15)8(16,17)4(3)18-2-6(12,13)5(10)11/h5H,1-2H2
InChIKeyZEWKKGSPBQAVRN-UHFFFAOYSA-N
XLogP3.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.11
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene?
The IUPAC name of 1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene (CID 175337705) is 1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene.
What is the SMILES notation for 1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene?
The canonical SMILES for 1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene is FC1=C(OCC(F)(F)C(F)F)C(F)(F)C(F)(F)C1.
What is the InChIKey of 1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene?
The InChIKey is ZEWKKGSPBQAVRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5F9O/c9-3-1-7(14,15)8(16,17)4(3)18-2-6(12,13)5(10)11/h5H,1-2H2.
What are the key properties of 1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene?
1,3,3,4,4-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene has a molecular weight of 288.11 g/mol, XLogP of 3.76, 4 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-pentafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene is sourced from PubChem (CID 175337705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).